3-(aminomethyl)-N-cyclohexylpiperidin-3-amine

C12H25N3 — CID 105465481

IUPAC3-(aminomethyl)-N-cyclohexylpiperidin-3-amine
SMILESNCC1(NC2CCCCC2)CCCNC1
InChIInChI=1S/C12H25N3/c13-9-12(7-4-8-14-10-12)15-11-5-2-1-3-6-11/h11,14-15H,1-10,13H2
InChIKeyDVOQTPFPKDJSMW-UHFFFAOYSA-N
MW211.35 g/mol
LogP0.99
Rot. Bonds3

About 3-(aminomethyl)-N-cyclohexylpiperidin-3-amine

3-(aminomethyl)-N-cyclohexylpiperidin-3-amine (PubChem CID 105465481) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is 3-(aminomethyl)-N-cyclohexylpiperidin-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-cyclohexylpiperidin-3-amine
PubChem CID105465481
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name3-(aminomethyl)-N-cyclohexylpiperidin-3-amine
SMILESNCC1(NC2CCCCC2)CCCNC1
InChIInChI=1S/C12H25N3/c13-9-12(7-4-8-14-10-12)15-11-5-2-1-3-6-11/h11,14-15H,1-10,13H2
InChIKeyDVOQTPFPKDJSMW-UHFFFAOYSA-N
XLogP0.99
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-Cyclohexylpiperazine
CID 87298
ST038767
CID 729174
1,4-Diazaspiro[5.5]undecane
CID 10630733
1-Azaspiro(5.5)undecan-4-amine
CID 64981405
2,4-Pentanediamine, N2-cyclohexyl-4-methyl-
CID 109461
7,15-Diazadispiro[5.1.5.3]hexadecane
CID 15557869
(S)-6,6-Dimethylpiperidin-3-amine
CID 139330708
N-(2,2,6,6-Tetramethyl-4-piperidyl)ethylenediamine
CID 3018039
1-Methyl-1,4-diazaspiro[5.5]undecane
CID 20761876
4-Fluoro-1,4-diazaspiro[5.5]undecane
CID 138493250
3,4-Diamino-2,2,6,6-tetramethylpiperidine
CID 14416818
2-Butyl-2-methylpiperazine
CID 91315254

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-cyclohexylpiperidin-3-amine?
The IUPAC name of 3-(aminomethyl)-N-cyclohexylpiperidin-3-amine (CID 105465481) is 3-(aminomethyl)-N-cyclohexylpiperidin-3-amine.
What is the SMILES notation for 3-(aminomethyl)-N-cyclohexylpiperidin-3-amine?
The canonical SMILES for 3-(aminomethyl)-N-cyclohexylpiperidin-3-amine is NCC1(NC2CCCCC2)CCCNC1.
What is the InChIKey of 3-(aminomethyl)-N-cyclohexylpiperidin-3-amine?
The InChIKey is DVOQTPFPKDJSMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c13-9-12(7-4-8-14-10-12)15-11-5-2-1-3-6-11/h11,14-15H,1-10,13H2.
What are the key properties of 3-(aminomethyl)-N-cyclohexylpiperidin-3-amine?
3-(aminomethyl)-N-cyclohexylpiperidin-3-amine has a molecular weight of 211.35 g/mol, XLogP of 0.99, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-cyclohexylpiperidin-3-amine is sourced from PubChem (CID 105465481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).