N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine

C14H29N3 — CID 83011927

IUPACN-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine
SMILESCC1CCCC(CN)(NN2CCCCC2)C1C
InChIInChI=1S/C14H29N3/c1-12-7-6-8-14(11-15,13(12)2)16-17-9-4-3-5-10-17/h12-13,16H,3-11,15H2,1-2H3
InChIKeyWFKKJABBIWXWQK-UHFFFAOYSA-N
MW239.41 g/mol
LogP2.13
Rot. Bonds3

About N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine

N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine (PubChem CID 83011927) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine.

Molecular Properties

Compound NameN-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine
PubChem CID83011927
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine
SMILESCC1CCCC(CN)(NN2CCCCC2)C1C
InChIInChI=1S/C14H29N3/c1-12-7-6-8-14(11-15,13(12)2)16-17-9-4-3-5-10-17/h12-13,16H,3-11,15H2,1-2H3
InChIKeyWFKKJABBIWXWQK-UHFFFAOYSA-N
XLogP2.13
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(aminomethyl)-2-methylcyclohexyl]piperidin-1-amine
CID 83011943
N-[1-(aminomethyl)-2,4-dimethylcyclohexyl]piperidin-1-amine
CID 83011621
N-[1-(aminomethyl)-2,5-dimethylcyclohexyl]piperidin-1-amine
CID 83010910
N-[1-(aminomethyl)-4-propan-2-ylcycloheptyl]piperidin-1-amine
CID 83011025
N-[1-(aminomethyl)-3-cyclopropylcyclohexyl]piperidin-1-amine
CID 83011314
1-(aminomethyl)-2,3-dimethyl-N-(1-phenylethyl)cyclohexan-1-amine
CID 65194136
N-[3-(aminomethyl)-5-methylthiolan-3-yl]piperidin-1-amine
CID 83010917
N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]-3-methylaniline
CID 65378408
[1-(2,2-dimethylpyrrolidin-1-yl)-2,3-dimethylcyclohexyl]methanamine
CID 64763160
1-(aminomethyl)-N-ethyl-2-methylcyclopentan-1-amine
CID 65045214
N-[4-(aminomethyl)-2-ethyloxan-4-yl]piperidin-1-amine
CID 83012158
2-[2,3-dimethyl-1-(methylamino)cyclohexyl]acetic acid
CID 65236824

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine?
The IUPAC name of N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine (CID 83011927) is N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine.
What is the SMILES notation for N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine?
The canonical SMILES for N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine is CC1CCCC(CN)(NN2CCCCC2)C1C.
What is the InChIKey of N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine?
The InChIKey is WFKKJABBIWXWQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-12-7-6-8-14(11-15,13(12)2)16-17-9-4-3-5-10-17/h12-13,16H,3-11,15H2,1-2H3.
What are the key properties of N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine?
N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine has a molecular weight of 239.41 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)-2,3-dimethylcyclohexyl]piperidin-1-amine is sourced from PubChem (CID 83011927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).