2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine

C15H32N2 — CID 62701630

IUPAC2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine
SMILESCCC(CC)N(C)C1CC(C(C)C)CCC1N
InChIInChI=1S/C15H32N2/c1-6-13(7-2)17(5)15-10-12(11(3)4)8-9-14(15)16/h11-15H,6-10,16H2,1-5H3
InChIKeyQJLDULICUMFLMM-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.26
Rot. Bonds5

About 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine

2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine (PubChem CID 62701630) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine.

Molecular Properties

Compound Name2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine
PubChem CID62701630
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine
SMILESCCC(CC)N(C)C1CC(C(C)C)CCC1N
InChIInChI=1S/C15H32N2/c1-6-13(7-2)17(5)15-10-12(11(3)4)8-9-14(15)16/h11-15H,6-10,16H2,1-5H3
InChIKeyQJLDULICUMFLMM-UHFFFAOYSA-N
XLogP3.26
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine 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

2-N-methyl-2-N-(3-methylbutan-2-yl)-4-propan-2-ylcyclohexane-1,2-diamine
CID 55105769
2-N-methyl-2-N-pentan-3-ylcyclohexane-1,2-diamine
CID 43570969
2-N-(4-ethylcyclohexyl)-2-N-methyl-4-propan-2-ylcyclohexane-1,2-diamine
CID 63469238
2-N,2-N-bis(3-methylbutyl)-4-propan-2-ylcyclohexane-1,2-diamine
CID 107869613
2-N-cycloheptyl-2-N-methyl-4-propan-2-ylcyclohexane-1,2-diamine
CID 63469021
4-propan-2-ylcyclohexane-1,2-diamine
CID 22415223
2-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 63493385
2-(aminomethyl)-N-methyl-N-pentan-3-ylcyclobutan-1-amine
CID 80998114
4-ethyl-2-N-methyl-2-N-propan-2-ylcyclohexane-1,2-diamine
CID 16781866
2-[[cyclopropylmethyl(methyl)amino]methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62709059
2-N-methyl-2-N-(1-methylpiperidin-3-yl)-4-propan-2-ylcyclohexane-1,2-diamine
CID 62708595
3-N-methyl-1,1-dioxo-3-N-pentan-3-ylthiolane-3,4-diamine
CID 62693591

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine?
The IUPAC name of 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine (CID 62701630) is 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine.
What is the SMILES notation for 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine?
The canonical SMILES for 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine is CCC(CC)N(C)C1CC(C(C)C)CCC1N.
What is the InChIKey of 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine?
The InChIKey is QJLDULICUMFLMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-6-13(7-2)17(5)15-10-12(11(3)4)8-9-14(15)16/h11-15H,6-10,16H2,1-5H3.
What are the key properties of 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine?
2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine has a molecular weight of 240.43 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-2-N-pentan-3-yl-4-propan-2-ylcyclohexane-1,2-diamine is sourced from PubChem (CID 62701630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).