1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine

C60H138N18 — CID 158563496

IUPAC1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine
SMILESCC(C)(N)CN1CCNCC1(C)C.CC(N)C(C)N1CCNCC1(C)C.CC(N)CCN1CCNCC1(C)C.CC(N)CN1CCNCC1(C)C.CCC(N)CN1CCNCC1(C)C.CCCC(N)CN1CCNCC1(C)C
InChIInChI=1S/C11H25N3.4C10H23N3.C9H21N3/c1-4-5-10(12)8-14-7-6-13-9-11(14,2)3;1-9(2,11)8-13-6-5-12-7-10(13,3)4;1-8(11)9(2)13-6-5-12-7-10(13,3)4;1-9(11)4-6-13-7-5-12-8-10(13,2)3;1-4-9(11)7-13-6-5-12-8-10(13,2)3;1-8(10)6-12-5-4-11-7-9(12,2)3/h10,13H,4-9,12H2,1-3H3;12H,5-8,11H2,1-4H3;8-9,12H,5-7,11H2,1-4H3;2*9,12H,4-8,11H2,1-3H3;8,11H,4-7,10H2,1-3H3
InChIKeyHREJEDVGMRNBAS-UHFFFAOYSA-N
MW1111.89 g/mol
LogP2.44
Rot. Bonds16

About 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine

1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine (PubChem CID 158563496) has the molecular formula C60H138N18 and a molecular weight of 1111.89 g/mol. Its IUPAC name is 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine
PubChem CID158563496
Molecular FormulaC60H138N18
Molecular Weight1111.89 g/mol
Exact Mass1111.14
IUPAC Name1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine
SMILESCC(C)(N)CN1CCNCC1(C)C.CC(N)C(C)N1CCNCC1(C)C.CC(N)CCN1CCNCC1(C)C.CC(N)CN1CCNCC1(C)C.CCC(N)CN1CCNCC1(C)C.CCCC(N)CN1CCNCC1(C)C
InChIInChI=1S/C11H25N3.4C10H23N3.C9H21N3/c1-4-5-10(12)8-14-7-6-13-9-11(14,2)3;1-9(2,11)8-13-6-5-12-7-10(13,3)4;1-8(11)9(2)13-6-5-12-7-10(13,3)4;1-9(11)4-6-13-7-5-12-8-10(13,2)3;1-4-9(11)7-13-6-5-12-8-10(13,2)3;1-8(10)6-12-5-4-11-7-9(12,2)3/h10,13H,4-9,12H2,1-3H3;12H,5-8,11H2,1-4H3;8-9,12H,5-7,11H2,1-4H3;2*9,12H,4-8,11H2,1-3H3;8,11H,4-7,10H2,1-3H3
InChIKeyHREJEDVGMRNBAS-UHFFFAOYSA-N
XLogP2.44
TPSA247.74 Ų
H-Bond Donors12
H-Bond Acceptors18
Rotatable Bonds16
Heavy Atoms78
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001111.89
LogP ≤ 52.44
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1018

Analyze 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine with MolForge

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Launch Full Analysis

Related Compounds

1-(2,2-Difluorobutyl)-4-methanidylpiperazin-4-ium;1-(2,2-difluoroethyl)-4-methanidylpiperazin-4-ium;1-(2,2-difluoropropyl)-4-methanidylpiperazin-4-ium;1-(2-fluoroethyl)-4-methanidylpiperazin-4-ium;1-(1-fluoro-2-methylpropan-2-yl)-4-methanidylpiperazin-4-ium;1-methanidyl-4-(2,2,2-trifluoroethyl)piperazin-1-ium
CID 157944169
1-(2,2-difluorobutyl)-4-methanidylpiperazin-4-ium;1-(2,2-difluoroethyl)-4-methanidylpiperazin-4-ium;1-(2,2-difluoropropyl)-4-methanidylpiperazin-4-ium;1-(2-fluoroethyl)-4-methanidylpiperazin-4-ium;1-(1-fluoro-2-methylpropan-2-yl)-4-methanidylpiperazin-4-ium;(2R,6S)-4-methanidyl-1,2,6-trimethylpiperazin-4-ium
CID 160162269
1-tert-butyl-4-(4-isocyanopiperidin-1-yl)piperidine;4-(4-tert-butylpiperazin-1-yl)butanenitrile;4-[(1-tert-butylpiperidin-4-yl)-methylamino]butanenitrile;N-(2,2-difluoropropyl)-1-propan-2-ylpiperidin-4-amine
CID 160428764
N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine;N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine;1-butyl-2,2,6,6-tetramethylpiperidin-4-amine
CID 44148487
2-(4-dodecyl-1,4-diazoniabicyclo[2.2.2]octan-1-yl)-N-[2-(4-dodecyl-1,4-diazoniabicyclo[2.2.2]octan-1-yl)ethyl]ethanamine
CID 162669953
N'-[2-(6-aminohexylamino)ethyl]-N,N,1,1-tetrakis(2,2,6,6-tetramethylpiperidin-4-yl)hexane-1,6-diamine;N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)hexane-1,6-diamine
CID 88787024
N-methyl-3-piperazin-1-ylpropan-1-amine;N-methyl-4-piperidin-1-ylbutan-1-amine;2-piperazin-1-ylethanamine;2-piperidin-1-ylethanamine;3-piperidin-1-ylpropan-1-amine
CID 90722711
3-[4-[3-(methylamino)propyl]piperazin-1-yl]propan-1-amine;N-methyl-2-piperazin-1-ylethanamine;N-methyl-3-piperazin-1-ylpropan-1-amine;1-methylpiperidine
CID 90988077
1,4,7,10-Tetrakis(piperidin-2-ylmethyl)-1,4,7,10-tetrazacyclododecane
CID 118551575
N-[2-[bis(2,2,6,6-tetramethylpiperidin-4-yl)amino]ethyl]-N,N',N'-tris(2,2,6,6-tetramethylpiperidin-4-yl)ethane-1,2-diamine
CID 140348178
1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;N,N-dimethyl-1-propan-2-ylpiperidin-3-amine;1-N-methyl-3-N-[2-(propan-2-ylamino)ethyl]butane-1,3-diamine
CID 145666779
(2R,6S)-1-tert-butyl-2-[2-[1-tert-butyl-4-(1-tert-butylpiperidin-4-yl)-6-methylpiperazin-2-yl]ethyl]-4-[1-[5-[4-[1-(2,2-dimethylpropyl)piperidin-4-yl]-2,6-dimethylpiperazin-1-yl]-2,5-dimethylhexan-2-yl]piperidin-4-yl]-6-methylpiperazine
CID 146549605

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine?
The IUPAC name of 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine (CID 158563496) is 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine.
What is the SMILES notation for 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine?
The canonical SMILES for 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine is CC(C)(N)CN1CCNCC1(C)C.CC(N)C(C)N1CCNCC1(C)C.CC(N)CCN1CCNCC1(C)C.CC(N)CN1CCNCC1(C)C.CCC(N)CN1CCNCC1(C)C.CCCC(N)CN1CCNCC1(C)C.
What is the InChIKey of 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine?
The InChIKey is HREJEDVGMRNBAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3.4C10H23N3.C9H21N3/c1-4-5-10(12)8-14-7-6-13-9-11(14,2)3;1-9(2,11)8-13-6-5-12-7-10(13,3)4;1-8(11)9(2)13-6-5-12-7-10(13,3)4;1-9(11)4-6-13-7-5-12-8-10(13,2)3;1-4-9(11)7-13-6-5-12-8-10(13,2)3;1-8(10)6-12-5-4-11-7-9(12,2)3/h10,13H,4-9,12H2,1-3H3;12H,5-8,11H2,1-4H3;8-9,12H,5-7,11H2,1-4H3;2*9,12H,4-8,11H2,1-3H3;8,11H,4-7,10H2,1-3H3.
What are the key properties of 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine?
1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine has a molecular weight of 1111.89 g/mol, XLogP of 2.44, 16 rotatable bonds, 12 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpiperazin-1-yl)butan-2-amine;3-(2,2-dimethylpiperazin-1-yl)butan-2-amine;4-(2,2-dimethylpiperazin-1-yl)butan-2-amine;1-(2,2-dimethylpiperazin-1-yl)-2-methylpropan-2-amine;1-(2,2-dimethylpiperazin-1-yl)pentan-2-amine;1-(2,2-dimethylpiperazin-1-yl)propan-2-amine is sourced from PubChem (CID 158563496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).