2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine

C14H30N2 — CID 64723008

IUPAC2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine
SMILESCCCC(C)N(C)C1C(C)CC(C)CC1N
InChIInChI=1S/C14H30N2/c1-6-7-12(4)16(5)14-11(3)8-10(2)9-13(14)15/h10-14H,6-9,15H2,1-5H3
InChIKeyKIQPDYZSFHZHTR-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.87
Rot. Bonds4

About 2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine

2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine (PubChem CID 64723008) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine.

Molecular Properties

Compound Name2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine
PubChem CID64723008
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine
SMILESCCCC(C)N(C)C1C(C)CC(C)CC1N
InChIInChI=1S/C14H30N2/c1-6-7-12(4)16(5)14-11(3)8-10(2)9-13(14)15/h10-14H,6-9,15H2,1-5H3
InChIKeyKIQPDYZSFHZHTR-UHFFFAOYSA-N
XLogP2.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dimethyl-2-N,2-N-dipropylcyclohexane-1,2-diamine
CID 64724227
1-[(2,4-dimethylcyclobutyl)-methylamino]butan-1-ol
CID 89249287
3-N-methyl-3-N-pentan-2-ylcyclopentane-1,3-diamine
CID 79467905
1-N-methyl-1-N-pentan-2-ylcyclohexane-1,3-diamine
CID 79467774
2-N,3,5-trimethyl-2-N-(4-methylpentan-2-yl)-1-N-propylcyclohexane-1,2-diamine
CID 64751152
2-N,3,5-trimethyl-2-N-(oxolan-3-yl)cyclohexane-1,2-diamine
CID 82734062
2-N-(3-methoxypropyl)-2-N,3,5-trimethylcyclohexane-1,2-diamine
CID 64751365
(1R,2S,4R)-2,4-dimethylcyclopentan-1-amine
CID 134253027
(4S)-2-ethyl-4-methylcyclopentan-1-amine
CID 163423682
3,5-dimethyl-2-(3-methylbutoxy)cyclohexan-1-amine
CID 64752970
1-N-ethyl-2-N,3,5-trimethyl-2-N-(3-methylbutan-2-yl)cyclohexane-1,2-diamine
CID 64722812
2-[[butan-2-yl(2-methoxyethyl)amino]methyl]-3,5-dimethylcyclohexan-1-amine
CID 64734672

Frequently Asked Questions

What is the IUPAC name of 2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine?
The IUPAC name of 2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine (CID 64723008) is 2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine.
What is the SMILES notation for 2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine?
The canonical SMILES for 2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine is CCCC(C)N(C)C1C(C)CC(C)CC1N.
What is the InChIKey of 2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine?
The InChIKey is KIQPDYZSFHZHTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-6-7-12(4)16(5)14-11(3)8-10(2)9-13(14)15/h10-14H,6-9,15H2,1-5H3.
What are the key properties of 2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine?
2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine has a molecular weight of 226.41 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,3,5-trimethyl-2-N-pentan-2-ylcyclohexane-1,2-diamine is sourced from PubChem (CID 64723008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).