1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine

C18H30N2 — CID 105006471

IUPAC1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine
SMILESCCCCC1CCC(C(NC)c2cnccc2C)CC1
InChIInChI=1S/C18H30N2/c1-4-5-6-15-7-9-16(10-8-15)18(19-3)17-13-20-12-11-14(17)2/h11-13,15-16,18-19H,4-10H2,1-3H3
InChIKeyIMCUAVJXQWPYSI-UHFFFAOYSA-N
MW274.45 g/mol
LogP4.65
Rot. Bonds6

About 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine

1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine (PubChem CID 105006471) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine.

Molecular Properties

Compound Name1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine
PubChem CID105006471
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC Name1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine
SMILESCCCCC1CCC(C(NC)c2cnccc2C)CC1
InChIInChI=1S/C18H30N2/c1-4-5-6-15-7-9-16(10-8-15)18(19-3)17-13-20-12-11-14(17)2/h11-13,15-16,18-19H,4-10H2,1-3H3
InChIKeyIMCUAVJXQWPYSI-UHFFFAOYSA-N
XLogP4.65
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine 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

1-(4-butylcyclohexyl)-N-methyl-1-pyrazin-2-ylmethanamine
CID 115860477
1-(4-butylcyclohexyl)-1-(3,4-dimethylphenyl)-N-methylmethanamine
CID 43480190
1-(4-butylcyclohexyl)-1-(2,6-difluorophenyl)-N-methylmethanamine
CID 115859834
[(3-ethylcyclopentyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105233566
N-methyl-1-(4-propylcyclohexyl)-1-(2,4,5-trimethylphenyl)methanamine
CID 65424736
1-(4-butylcyclohexyl)-2-pyridin-3-ylethanamine
CID 105034554
1-(5-bromo-4-methylthiophen-2-yl)-1-(4-butylcyclohexyl)-N-methylmethanamine
CID 79991749
1-(3-bromo-5-methylthiophen-2-yl)-1-(4-butylcyclohexyl)-N-methylmethanamine
CID 65279032
1-(4-butylcyclohexyl)-1-(5-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105026025
1-(5-bromothiophen-2-yl)-1-(4-butylcyclohexyl)-N-methylmethanamine
CID 55196072
[(4-tert-butylcyclohexyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105232736
1-(4-fluoro-2-methylphenyl)-N-methyl-1-(4-propylcyclohexyl)methanamine
CID 65422994

Frequently Asked Questions

What is the IUPAC name of 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine?
The IUPAC name of 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine (CID 105006471) is 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine.
What is the SMILES notation for 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine?
The canonical SMILES for 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine is CCCCC1CCC(C(NC)c2cnccc2C)CC1.
What is the InChIKey of 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine?
The InChIKey is IMCUAVJXQWPYSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-4-5-6-15-7-9-16(10-8-15)18(19-3)17-13-20-12-11-14(17)2/h11-13,15-16,18-19H,4-10H2,1-3H3.
What are the key properties of 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine?
1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine has a molecular weight of 274.45 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-butylcyclohexyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine is sourced from PubChem (CID 105006471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).