4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine

C15H24N2O — CID 115213420

IUPAC4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine
SMILESCOc1ccc(CNCC2CCC(N)CC2)cc1
InChIInChI=1S/C15H24N2O/c1-18-15-8-4-13(5-9-15)11-17-10-12-2-6-14(16)7-3-12/h4-5,8-9,12,14,17H,2-3,6-7,10-11,16H2,1H3
InChIKeyGGWVUNUZTYTBBO-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.30
Rot. Bonds5

About 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine

4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine (PubChem CID 115213420) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine
PubChem CID115213420
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine
SMILESCOc1ccc(CNCC2CCC(N)CC2)cc1
InChIInChI=1S/C15H24N2O/c1-18-15-8-4-13(5-9-15)11-17-10-12-2-6-14(16)7-3-12/h4-5,8-9,12,14,17H,2-3,6-7,10-11,16H2,1H3
InChIKeyGGWVUNUZTYTBBO-UHFFFAOYSA-N
XLogP2.30
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine 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

3-[[(4-methoxyphenyl)methylamino]methyl]cyclobutan-1-amine
CID 115214033
4-[[(4-fluorophenyl)methylamino]methyl]cyclohexan-1-amine
CID 115213417
2-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-ol
CID 64927668
N-[(4-methoxyphenyl)methyl]-1-piperidin-3-ylmethanamine
CID 80553020
N-[(4-methoxyphenyl)methyl]-1-(2-methylcyclopropyl)methanamine
CID 115594150
N-benzyl-1-[3-(4-methoxyphenyl)cyclopentyl]methanamine;hydrochloride
CID 18784188
3-[[(6-methoxynaphthalen-2-yl)methylamino]methyl]cyclopentan-1-ol
CID 103270839
1-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]methanamine;dihydrochloride
CID 67859421
[4-[(cyclopropylmethylamino)methyl]phenyl]methanol
CID 83962663
(Z)-2-amino-2-[4-[[(4-aminocyclohexyl)methylamino]methyl]phenyl]ethenethiol
CID 89020362
4-[[(4-fluoro-3-methylphenyl)methylamino]methyl]cyclohexan-1-amine
CID 115213421
2-(cyclopropylmethylamino)-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]acetamide;hydrochloride
CID 119753123

Frequently Asked Questions

What is the IUPAC name of 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine?
The IUPAC name of 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine (CID 115213420) is 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine?
The canonical SMILES for 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine is COc1ccc(CNCC2CCC(N)CC2)cc1.
What is the InChIKey of 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine?
The InChIKey is GGWVUNUZTYTBBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-18-15-8-4-13(5-9-15)11-17-10-12-2-6-14(16)7-3-12/h4-5,8-9,12,14,17H,2-3,6-7,10-11,16H2,1H3.
What are the key properties of 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine?
4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 115213420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).