N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine

C14H29N — CID 81028967

IUPACN-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine
SMILESCCCC1CC(C(C)C)CCC1CNC
InChIInChI=1S/C14H29N/c1-5-6-13-9-12(11(2)3)7-8-14(13)10-15-4/h11-15H,5-10H2,1-4H3
InChIKeyJHIHWQKQDVTGKY-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.69
Rot. Bonds5

About N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine

N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine (PubChem CID 81028967) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine
PubChem CID81028967
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC NameN-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine
SMILESCCCC1CC(C(C)C)CCC1CNC
InChIInChI=1S/C14H29N/c1-5-6-13-9-12(11(2)3)7-8-14(13)10-15-4/h11-15H,5-10H2,1-4H3
InChIKeyJHIHWQKQDVTGKY-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine 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-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine?
The IUPAC name of N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine (CID 81028967) is N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine.
What is the SMILES notation for N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine?
The canonical SMILES for N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine is CCCC1CC(C(C)C)CCC1CNC.
What is the InChIKey of N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine?
The InChIKey is JHIHWQKQDVTGKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-5-6-13-9-12(11(2)3)7-8-14(13)10-15-4/h11-15H,5-10H2,1-4H3.
What are the key properties of N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine?
N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine has a molecular weight of 211.39 g/mol, XLogP of 3.69, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-propan-2-yl-2-propylcyclohexyl)methanamine is sourced from PubChem (CID 81028967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).