N-(2,3-dimethylbutan-2-yl)cyclohexanamine

C12H25N — CID 89164056

IUPACN-(2,3-dimethylbutan-2-yl)cyclohexanamine
SMILESCC(C)C(C)(C)NC1CCCCC1
InChIInChI=1S/C12H25N/c1-10(2)12(3,4)13-11-8-6-5-7-9-11/h10-11,13H,5-9H2,1-4H3
InChIKeyTYVGKOBGKCSLTN-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.34
Rot. Bonds3

About N-(2,3-dimethylbutan-2-yl)cyclohexanamine

N-(2,3-dimethylbutan-2-yl)cyclohexanamine (PubChem CID 89164056) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is N-(2,3-dimethylbutan-2-yl)cyclohexanamine.

Molecular Properties

Compound NameN-(2,3-dimethylbutan-2-yl)cyclohexanamine
PubChem CID89164056
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC NameN-(2,3-dimethylbutan-2-yl)cyclohexanamine
SMILESCC(C)C(C)(C)NC1CCCCC1
InChIInChI=1S/C12H25N/c1-10(2)12(3,4)13-11-8-6-5-7-9-11/h10-11,13H,5-9H2,1-4H3
InChIKeyTYVGKOBGKCSLTN-UHFFFAOYSA-N
XLogP3.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2,3-dimethylbutan-2-yl)cyclohexanamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylbutan-2-yl)cyclohexanamine?
The IUPAC name of N-(2,3-dimethylbutan-2-yl)cyclohexanamine (CID 89164056) is N-(2,3-dimethylbutan-2-yl)cyclohexanamine.
What is the SMILES notation for N-(2,3-dimethylbutan-2-yl)cyclohexanamine?
The canonical SMILES for N-(2,3-dimethylbutan-2-yl)cyclohexanamine is CC(C)C(C)(C)NC1CCCCC1.
What is the InChIKey of N-(2,3-dimethylbutan-2-yl)cyclohexanamine?
The InChIKey is TYVGKOBGKCSLTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-10(2)12(3,4)13-11-8-6-5-7-9-11/h10-11,13H,5-9H2,1-4H3.
What are the key properties of N-(2,3-dimethylbutan-2-yl)cyclohexanamine?
N-(2,3-dimethylbutan-2-yl)cyclohexanamine has a molecular weight of 183.34 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylbutan-2-yl)cyclohexanamine is sourced from PubChem (CID 89164056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).