2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine

C15H24N2O — CID 115118101

IUPAC2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine
SMILESCOc1ccccc1CCNC1CCCCC1N
InChIInChI=1S/C15H24N2O/c1-18-15-9-5-2-6-12(15)10-11-17-14-8-4-3-7-13(14)16/h2,5-6,9,13-14,17H,3-4,7-8,10-11,16H2,1H3
InChIKeyQYNVPXXNJMQNGS-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.10
Rot. Bonds5

About 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine

2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine (PubChem CID 115118101) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine.

Molecular Properties

Compound Name2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine
PubChem CID115118101
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine
SMILESCOc1ccccc1CCNC1CCCCC1N
InChIInChI=1S/C15H24N2O/c1-18-15-9-5-2-6-12(15)10-11-17-14-8-4-3-7-13(14)16/h2,5-6,9,13-14,17H,3-4,7-8,10-11,16H2,1H3
InChIKeyQYNVPXXNJMQNGS-UHFFFAOYSA-N
XLogP2.10
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 ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine 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

trans-(1S,2S)-2-methoxy-N-[2-(2-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 768564
cis-(1S,2R)-2-methoxy-N-[2-(2-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 768559
2-amino-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1-carboxamide
CID 103808135
N-(2-aminocyclohexyl)-2-(2-methoxyphenyl)acetamide
CID 55149839
3-N-[2-(2-methoxyphenyl)ethyl]cyclopentane-1,3-diamine
CID 114165383
trans-(1R,2R)-1-N,2-N-bis[(2-methoxyphenyl)methyl]cyclohexane-1,2-diamine
CID 71414214
4-[[2-(2-methoxyphenyl)ethylamino]methyl]cyclohexan-1-amine
CID 115213507
2-cyclopropyl-N-[2-(2-methoxyphenyl)ethyl]ethanamine
CID 106261295
N-[2-(2-methoxyphenyl)ethyl]-1-methylpiperidin-4-amine
CID 113218952
trans-(1S,2R)-2-ethyl-N-[(2-methoxyphenyl)methyl]cyclohexan-1-amine
CID 93046208
N-[2-(2-methoxyphenyl)ethyl]thian-3-amine
CID 103885574
4-tert-butyl-N-[2-(2-methoxyphenyl)ethyl]cyclohexan-1-amine
CID 783786

Frequently Asked Questions

What is the IUPAC name of 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine?
The IUPAC name of 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine (CID 115118101) is 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine.
What is the SMILES notation for 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine?
The canonical SMILES for 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine is COc1ccccc1CCNC1CCCCC1N.
What is the InChIKey of 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine?
The InChIKey is QYNVPXXNJMQNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-18-15-9-5-2-6-12(15)10-11-17-14-8-4-3-7-13(14)16/h2,5-6,9,13-14,17H,3-4,7-8,10-11,16H2,1H3.
What are the key properties of 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine?
2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine has a molecular weight of 248.37 g/mol, XLogP of 2.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-(2-methoxyphenyl)ethyl]cyclohexane-1,2-diamine is sourced from PubChem (CID 115118101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).