2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine

C16H32N2 — CID 43329364

IUPAC2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine
SMILESCCC1CCC(CN)C(N(C)C2CCCCC2)C1
InChIInChI=1S/C16H32N2/c1-3-13-9-10-14(12-17)16(11-13)18(2)15-7-5-4-6-8-15/h13-16H,3-12,17H2,1-2H3
InChIKeyAWCSERMAHWWYHC-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.40
Rot. Bonds4

About 2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine

2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine (PubChem CID 43329364) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine
PubChem CID43329364
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine
SMILESCCC1CCC(CN)C(N(C)C2CCCCC2)C1
InChIInChI=1S/C16H32N2/c1-3-13-9-10-14(12-17)16(11-13)18(2)15-7-5-4-6-8-15/h13-16H,3-12,17H2,1-2H3
InChIKeyAWCSERMAHWWYHC-UHFFFAOYSA-N
XLogP3.40
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(aminomethyl)-5-ethylcyclohexyl]-N-methylcycloheptanamine
CID 43613832
2-(aminomethyl)-N-cyclopentyl-N-methylcyclopentan-1-amine
CID 43293690
2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine
CID 43293397
2-(aminomethyl)-5-ethyl-N-methyl-N-(3-methylbutan-2-yl)cyclohexan-1-amine
CID 43569707
2-(aminomethyl)-N-cyclopropyl-5-ethyl-N-(2-methylpropyl)cyclohexan-1-amine
CID 55002153
2-(aminomethyl)-5-ethyl-N-(2-methoxyethyl)-N-methylcyclohexan-1-amine
CID 61427073
N-[2-(aminomethyl)-5-propylcyclohexyl]-N-methylthiolan-3-amine
CID 43530795
2-(aminomethyl)-5-ethyl-N-methyl-N-(oxolan-2-ylmethyl)cyclohexan-1-amine
CID 61431165
2-(aminomethyl)-N-(cyclopropylmethyl)-5-ethyl-N-propylcyclohexan-1-amine
CID 43478976
N-[2-(aminomethyl)cycloheptyl]-N,1-dimethylpiperidin-4-amine
CID 43329366
2-(aminomethyl)-N-butyl-N,5-diethylcyclohexan-1-amine
CID 43293551
3-[[2-(aminomethyl)-5-ethylcyclohexyl]-methylamino]-N-methylpropanamide
CID 106914850

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine (CID 43329364) is 2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine is CCC1CCC(CN)C(N(C)C2CCCCC2)C1.
What is the InChIKey of 2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine?
The InChIKey is AWCSERMAHWWYHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-3-13-9-10-14(12-17)16(11-13)18(2)15-7-5-4-6-8-15/h13-16H,3-12,17H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine?
2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine has a molecular weight of 252.45 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine is sourced from PubChem (CID 43329364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).