2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol

C64H137N11O5 — CID 158660523

IUPAC2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol
SMILESCC(C)C(=O)NC1CCN(C)CC1.CC(C)N(C)CCO.CC(C)N1CCC(C)(O)CC1.CC(C)N1CCC(CCO)CC1.CC(C)N1CCC(N2CCN(C)CC2)CC1.CC(C)N1CCC(O)CC1.CC(C)N1CCN(C)CC1
InChIInChI=1S/C13H27N3.C10H20N2O.C10H21NO.C9H19NO.C8H18N2.C8H17NO.C6H15NO/c1-12(2)15-6-4-13(5-7-15)16-10-8-14(3)9-11-16;1-8(2)10(13)11-9-4-6-12(3)7-5-9;1-9(2)11-6-3-10(4-7-11)5-8-12;1-8(2)10-6-4-9(3,11)5-7-10;1-8(2)10-6-4-9(3)5-7-10;1-7(2)9-5-3-8(10)4-6-9;1-6(2)7(3)4-5-8/h12-13H,4-11H2,1-3H3;8-9H,4-7H2,1-3H3,(H,11,13);9-10,12H,3-8H2,1-2H3;8,11H,4-7H2,1-3H3;8H,4-7H2,1-3H3;7-8,10H,3-6H2,1-2H3;6,8H,4-5H2,1-3H3
InChIKeyICRVQSSZGIDFSS-UHFFFAOYSA-N
MW1140.87 g/mol
LogP6.50
Rot. Bonds13

About 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol

2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol (PubChem CID 158660523) has the molecular formula C64H137N11O5 and a molecular weight of 1140.87 g/mol. Its IUPAC name is 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol.

Molecular Properties

Compound Name2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol
PubChem CID158660523
Molecular FormulaC64H137N11O5
Molecular Weight1140.87 g/mol
Exact Mass1140.08
IUPAC Name2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol
SMILESCC(C)C(=O)NC1CCN(C)CC1.CC(C)N(C)CCO.CC(C)N1CCC(C)(O)CC1.CC(C)N1CCC(CCO)CC1.CC(C)N1CCC(N2CCN(C)CC2)CC1.CC(C)N1CCC(O)CC1.CC(C)N1CCN(C)CC1
InChIInChI=1S/C13H27N3.C10H20N2O.C10H21NO.C9H19NO.C8H18N2.C8H17NO.C6H15NO/c1-12(2)15-6-4-13(5-7-15)16-10-8-14(3)9-11-16;1-8(2)10(13)11-9-4-6-12(3)7-5-9;1-9(2)11-6-3-10(4-7-11)5-8-12;1-8(2)10-6-4-9(3,11)5-7-10;1-8(2)10-6-4-9(3)5-7-10;1-7(2)9-5-3-8(10)4-6-9;1-6(2)7(3)4-5-8/h12-13H,4-11H2,1-3H3;8-9H,4-7H2,1-3H3,(H,11,13);9-10,12H,3-8H2,1-2H3;8,11H,4-7H2,1-3H3;8H,4-7H2,1-3H3;7-8,10H,3-6H2,1-2H3;6,8H,4-5H2,1-3H3
InChIKeyICRVQSSZGIDFSS-UHFFFAOYSA-N
XLogP6.50
TPSA142.42 Ų
H-Bond Donors5
H-Bond Acceptors15
Rotatable Bonds13
Heavy Atoms80
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001140.87
LogP ≤ 56.50
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1015

Analyze 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol with MolForge

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Related Compounds

N-(5,5-difluoropiperidin-3-yl)-2-methylpropanamide;N-(1,3-dimethylpiperidin-3-yl)-2-methylpropanamide;N-(1,4-dimethylpiperidin-4-yl)-2-methylpropanamide;N,2-dimethyl-N-piperidin-4-ylpropanamide;N-[(3R,4S)-3-fluoropiperidin-4-yl]-2-methylpropanamide;N-[(3S,4S)-3-fluoropiperidin-4-yl]-2-methylpropanamide;N-[(3R,4R)-3-fluoropiperidin-4-yl]-2-methylpropanamide;N-[(3S,4S)-4-fluoropiperidin-3-yl]-2-methylpropanamide;N-[(3R,4R)-4-fluoropiperidin-3-yl]-2-methylpropanamide;N-(4-fluoropiperidin-3-yl)-2-methylpropanamide;N-(3-hydroxy-1-methylpiperidin-4-yl)-2-methylpropanamide;N-(4-hydroxy-1-methylpiperidin-3-yl)-2-methylpropanamide
CID 157766562
1,4-dimethylpiperazine;1,4-dimethylpiperidin-4-ol;ethane;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-(4-methylpiperazin-1-yl)ethanol;1-methylpiperidin-4-ol;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine
CID 157451595
N-butan-2-yl-1-propan-2-ylpiperidin-4-amine;1-(cyclohexylmethyl)-4-propan-2-ylpiperazine;1-cyclopropyl-4-propan-2-ylpiperazine;3,5-dimethyl-1-propan-2-ylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N-ethyl-1-propan-2-ylpiperidin-4-amine;4-(3-methylazetidin-1-yl)-1-propan-2-ylpiperidine;N-(2-methylpropyl)-1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperazine;1-(4-propan-2-ylpiperazin-1-yl)ethanone;1-[(1-propan-2-ylpiperidin-4-yl)amino]butan-2-ol;2-[(1-propan-2-ylpiperidin-4-yl)amino]butan-1-ol;3-[(1-propan-2-ylpiperidin-4-yl)amino]propan-1-ol
CID 157713019
(2S)-3-hydroxy-2-(methylamino)-1-(4-methylpiperidin-1-yl)propan-1-one;2-(methylamino)-1-(4-methylpiperidin-1-yl)ethanone;1-methylpiperazine;(2R)-3-(4-methylpiperazin-1-yl)propane-1,2-diol;4-methylpiperidine
CID 157902980
6-(dimethylamino)-2-methylhexan-3-one;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;2-methyl-1-(4-methylpiperazin-1-yl)propan-1-one;1-methyl-4-propan-2-ylpiperazine;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol;1-propan-2-yl-4-pyrrolidin-1-ylpiperidine
CID 158480366
1-methyl-4-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazin-2-one;4-methyl-1-propan-2-ylpiperazin-2-one;4-methyl-1-propan-2-ylpiperidine;N-methyl-1-propan-2-ylpiperidine-4-carboxamide;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carboxamide;1-propan-2-ylpiperidin-4-ol
CID 158498168
methane;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;2-(4-propan-2-ylpiperazin-1-yl)ethanol;1-propan-2-ylpiperidin-4-ol
CID 159074663
N,N-diethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-methylpropanamide;1-methyl-4-propan-2-ylpiperazine;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol
CID 159597243
(3S)-1,3-dimethylpiperazine;(2S)-3-hydroxy-2-(methylamino)-1-(4-methylpiperidin-1-yl)propan-1-one;1-methylpiperazine;4-methylpiperazin-2-one;[(2R)-4-methylpiperazin-2-yl]methanol;(2R)-3-(4-methylpiperazin-1-yl)propane-1,2-diol;1-methylpiperidin-4-amine;4-methylpiperidine
CID 160978440
1-Methyl-4-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazin-2-one;4-methyl-1-propan-2-ylpiperazin-2-one;4-methyl-1-propan-2-ylpiperidine;1-propan-2-ylpiperidin-4-amine;1-propan-2-ylpiperidine-4-carboxamide;1-propan-2-ylpiperidin-4-ol
CID 161255532
1-tert-butyl-4-methylpiperazine;1-tert-butyl-4-methylpiperidin-4-ol;2-(4-tert-butylpiperazin-1-yl)ethanol;1-tert-butylpiperidin-4-ol;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine
CID 161607788
2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;2-(4-propan-2-ylpiperazin-1-yl)ethanol;1-propan-2-ylpiperidin-4-ol
CID 161638897

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol?
The IUPAC name of 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol (CID 158660523) is 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol.
What is the SMILES notation for 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol?
The canonical SMILES for 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol is CC(C)C(=O)NC1CCN(C)CC1.CC(C)N(C)CCO.CC(C)N1CCC(C)(O)CC1.CC(C)N1CCC(CCO)CC1.CC(C)N1CCC(N2CCN(C)CC2)CC1.CC(C)N1CCC(O)CC1.CC(C)N1CCN(C)CC1.
What is the InChIKey of 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol?
The InChIKey is ICRVQSSZGIDFSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3.C10H20N2O.C10H21NO.C9H19NO.C8H18N2.C8H17NO.C6H15NO/c1-12(2)15-6-4-13(5-7-15)16-10-8-14(3)9-11-16;1-8(2)10(13)11-9-4-6-12(3)7-5-9;1-9(2)11-6-3-10(4-7-11)5-8-12;1-8(2)10-6-4-9(3,11)5-7-10;1-8(2)10-6-4-9(3)5-7-10;1-7(2)9-5-3-8(10)4-6-9;1-6(2)7(3)4-5-8/h12-13H,4-11H2,1-3H3;8-9H,4-7H2,1-3H3,(H,11,13);9-10,12H,3-8H2,1-2H3;8,11H,4-7H2,1-3H3;8H,4-7H2,1-3H3;7-8,10H,3-6H2,1-2H3;6,8H,4-5H2,1-3H3.
What are the key properties of 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol?
2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol has a molecular weight of 1140.87 g/mol, XLogP of 6.50, 13 rotatable bonds, 5 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-methylpiperidin-4-yl)propanamide;2-[methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;1-propan-2-ylpiperidin-4-ol;2-(1-propan-2-ylpiperidin-4-yl)ethanol is sourced from PubChem (CID 158660523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).