(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one

C103H220N16O4 — CID 157462722

IUPAC(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one
SMILESC.CC(C)N1CC(=O)N(C)CC1(C)C.CC(C)N1CCCCC1(C)C.CC(C)N1CCCCC1(C)C.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCN(C)C(=O)C1(C)C.CC(C)N1CCN(C)CC1(C)C.CC(C)N1CCN(C)[C@@H](C)C1.CC(C)N1CCN(C)[C@H](C)C1.CC(C)N1CCO[C@@H](C)C1.CC(C)N1CCO[C@H](C)C1
InChIInChI=1S/2C10H20N2O.C10H22N2.2C10H21N.2C9H20N2.2C9H19N.2C8H17NO.CH4/c1-8(2)12-6-9(13)11(5)7-10(12,3)4;1-8(2)12-7-6-11(5)9(13)10(12,3)4;1-9(2)12-7-6-11(5)8-10(12,3)4;2*1-9(2)11-8-6-5-7-10(11,3)4;2*1-8(2)11-6-5-10(4)9(3)7-11;2*1-8(2)10-6-4-5-9(3)7-10;2*1-7(2)9-4-5-10-8(3)6-9;/h2*8H,6-7H2,1-5H3;9H,6-8H2,1-5H3;2*9H,5-8H2,1-4H3;2*8-9H,5-7H2,1-4H3;2*8-9H,4-7H2,1-3H3;2*7-8H,4-6H2,1-3H3;1H4/t;;;;;4*9-;2*8-;/m.....101010./s1
InChIKeyBUCRYCWQIYEUGL-YHXWKLGBSA-N
MW1747.00 g/mol
LogP17.82
Rot. Bonds11

About (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one

(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one (PubChem CID 157462722) has the molecular formula C103H220N16O4 and a molecular weight of 1747.00 g/mol. Its IUPAC name is (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one.

Molecular Properties

Compound Name(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one
PubChem CID157462722
Molecular FormulaC103H220N16O4
Molecular Weight1747.00 g/mol
Exact Mass1745.75
IUPAC Name(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one
SMILESC.CC(C)N1CC(=O)N(C)CC1(C)C.CC(C)N1CCCCC1(C)C.CC(C)N1CCCCC1(C)C.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCN(C)C(=O)C1(C)C.CC(C)N1CCN(C)CC1(C)C.CC(C)N1CCN(C)[C@@H](C)C1.CC(C)N1CCN(C)[C@H](C)C1.CC(C)N1CCO[C@@H](C)C1.CC(C)N1CCO[C@H](C)C1
InChIInChI=1S/2C10H20N2O.C10H22N2.2C10H21N.2C9H20N2.2C9H19N.2C8H17NO.CH4/c1-8(2)12-6-9(13)11(5)7-10(12,3)4;1-8(2)12-7-6-11(5)9(13)10(12,3)4;1-9(2)12-7-6-11(5)8-10(12,3)4;2*1-9(2)11-8-6-5-7-10(11,3)4;2*1-8(2)11-6-5-10(4)9(3)7-11;2*1-8(2)10-6-4-5-9(3)7-10;2*1-7(2)9-4-5-10-8(3)6-9;/h2*8H,6-7H2,1-5H3;9H,6-8H2,1-5H3;2*9H,5-8H2,1-4H3;2*8-9H,5-7H2,1-4H3;2*8-9H,4-7H2,1-3H3;2*7-8H,4-6H2,1-3H3;1H4/t;;;;;4*9-;2*8-;/m.....101010./s1
InChIKeyBUCRYCWQIYEUGL-YHXWKLGBSA-N
XLogP17.82
TPSA104.44 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds11
Heavy Atoms123
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001747.00
LogP ≤ 517.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one with MolForge

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Launch Full Analysis

Related Compounds

(1-Acetyl-2,2,6,6-tetramethylpiperidin-4-yl) 2-[[2-(1-acetyl-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2-oxoethyl]-[2-[[2-(1-acetyl-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2-oxoethyl]-[2-[bis[2-(1-acetyl-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2-oxoethyl]amino]propyl]amino]propyl]amino]acetate
CID 54049257
(1-Acetyl-2,2,6,6-tetramethylpiperidin-4-yl) 2-[bis[2-[bis[2-(1-acetyl-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2-oxoethyl]amino]ethyl]amino]acetate
CID 88597836
(1-Butanoyl-2,2,6,6-tetramethylpiperidin-4-yl) 2-[bis[2-[bis[2-(1-butanoyl-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2-oxoethyl]amino]ethyl]amino]acetate
CID 88650685
2,2-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one
CID 157247075
1-Tert-butyl-4-(3,3-dimethylbutyl)piperazine;4-tert-butyl-1-(3,3-dimethylbutyl)piperazin-2-one;1-tert-butyl-4-(3,3-dimethylbutyl)piperidine;bis(1-tert-butyl-4-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]piperazine);1-tert-butyl-4-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]piperidine;1-tert-butyl-4-[1-(3,3-dimethylbutyl)piperidin-4-yl]oxypiperidine;1-tert-butyl-4-[[1-(5,5-dimethylhexyl)piperidin-4-yl]methyl]piperazine
CID 157973161
Tert-butyl 4-propan-2-ylpiperazine-1-carboxylate;1-[4-(dimethylamino)piperidin-1-yl]-2-methylpropan-1-one;2,6-dimethyl-4-propan-2-ylmorpholine;1,4-di(propan-2-yl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)-4-propan-2-ylpiperazine;1-propan-2-ylpiperidine;4-(1-propan-2-ylpiperidin-4-yl)morpholine
CID 158091013
4-Tert-butyl-1-(3,3-dimethylbutyl)piperazin-2-one;1-tert-butyl-4-(3,3-dimethylbutyl)piperidine;1-tert-butyl-4-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]piperazine;1-tert-butyl-4-[[1-(3,3-dimethylbutyl)piperidin-4-yl]methyl]piperidine;1-tert-butyl-4-[1-(3,3-dimethylbutyl)piperidin-4-yl]oxypiperidine;1-tert-butyl-4-[[1-(5,5-dimethylhexyl)piperidin-4-yl]methyl]piperazine
CID 158238177
2-[(3R)-4-[[1-(3,3-dimethylbutanoyl)piperidin-4-yl]methyl]-3-methylpiperazin-1-yl]-N,N-dimethylacetamide;3,3-dimethyl-1-[4-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]piperidin-1-yl]butan-1-one
CID 158557014
N-[2-(1-acetylpiperidin-4-yl)ethyl]-N-methylacetamide;2-(dimethylamino)-1-piperidin-1-ylethanone;N-ethyl-2-[4-(methoxymethyl)piperidin-1-yl]-N-methylethanamine;N-ethyl-2-(3-methoxypiperidin-1-yl)-N-methylethanamine;N-ethyl-2-(4-methoxypiperidin-1-yl)-N-methylethanamine;2-[ethyl(methyl)amino]-1-(4-ethylpiperazin-1-yl)ethanone;1-[4-[2-[ethyl(methyl)amino]ethyl]piperidin-1-yl]ethanone;N-ethyl-N-methyl-2-morpholin-4-ylethanamine;N-methyl-N-(2-piperidin-1-ylethyl)acetamide
CID 158586137
3-Tert-butyl-1,4-dimethylpiperazin-2-one;1-tert-butyl-4-ethylpiperazine;1-tert-butyl-4-methylpiperazine;4-tert-butylmorpholine;1-tert-butyl-4-propan-2-ylpiperazine;2,2-dimethyl-1-morpholin-4-ylpropan-1-one
CID 159255361
2,2-dimethyl-4-propan-2-ylmorpholine;3,3-dimethyl-4-propan-2-ylmorpholine;(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;2,2-dimethyl-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;1,2,2-trimethyl-4-propan-2-ylpiperazine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one
CID 159558479
(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one
CID 159789976

Frequently Asked Questions

What is the IUPAC name of (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one?
The IUPAC name of (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one (CID 157462722) is (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one.
What is the SMILES notation for (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one?
The canonical SMILES for (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one is C.CC(C)N1CC(=O)N(C)CC1(C)C.CC(C)N1CCCCC1(C)C.CC(C)N1CCCCC1(C)C.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCN(C)C(=O)C1(C)C.CC(C)N1CCN(C)CC1(C)C.CC(C)N1CCN(C)[C@@H](C)C1.CC(C)N1CCN(C)[C@H](C)C1.CC(C)N1CCO[C@@H](C)C1.CC(C)N1CCO[C@H](C)C1.
What is the InChIKey of (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one?
The InChIKey is BUCRYCWQIYEUGL-YHXWKLGBSA-N. The full InChI is InChI=1S/2C10H20N2O.C10H22N2.2C10H21N.2C9H20N2.2C9H19N.2C8H17NO.CH4/c1-8(2)12-6-9(13)11(5)7-10(12,3)4;1-8(2)12-7-6-11(5)9(13)10(12,3)4;1-9(2)12-7-6-11(5)8-10(12,3)4;2*1-9(2)11-8-6-5-7-10(11,3)4;2*1-8(2)11-6-5-10(4)9(3)7-11;2*1-8(2)10-6-4-5-9(3)7-10;2*1-7(2)9-4-5-10-8(3)6-9;/h2*8H,6-7H2,1-5H3;9H,6-8H2,1-5H3;2*9H,5-8H2,1-4H3;2*8-9H,5-7H2,1-4H3;2*8-9H,4-7H2,1-3H3;2*7-8H,4-6H2,1-3H3;1H4/t;;;;;4*9-;2*8-;/m.....101010./s1.
What are the key properties of (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one?
(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one has a molecular weight of 1747.00 g/mol, XLogP of 17.82, 11 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;bis(2,2-dimethyl-1-propan-2-ylpiperidine);methane;(2R)-2-methyl-4-propan-2-ylmorpholine;(2S)-2-methyl-4-propan-2-ylmorpholine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;2,2,4-trimethyl-1-propan-2-ylpiperazine;1,3,3-trimethyl-4-propan-2-ylpiperazin-2-one;1,5,5-trimethyl-4-propan-2-ylpiperazin-2-one is sourced from PubChem (CID 157462722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).