1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine

C16H17NO — CID 167713468

IUPAC1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine
SMILESCOc1ccc(-c2cccc(C3(N)CC3)c2)cc1
InChIInChI=1S/C16H17NO/c1-18-15-7-5-12(6-8-15)13-3-2-4-14(11-13)16(17)9-10-16/h2-8,11H,9-10,17H2,1H3
InChIKeyCEYMDHIACPDABO-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.31
Rot. Bonds3

About 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine

1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine (PubChem CID 167713468) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine
PubChem CID167713468
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine
SMILESCOc1ccc(-c2cccc(C3(N)CC3)c2)cc1
InChIInChI=1S/C16H17NO/c1-18-15-7-5-12(6-8-15)13-3-2-4-14(11-13)16(17)9-10-16/h2-8,11H,9-10,17H2,1H3
InChIKeyCEYMDHIACPDABO-UHFFFAOYSA-N
XLogP3.31
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-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

1-[3-(4-methoxyphenyl)phenyl]cyclopropane-1-carboxylic acid
CID 83556280
1-(3-pyridin-4-ylphenyl)cyclopropan-1-amine
CID 167713448
1-(3-phenylphenyl)cyclopentan-1-amine
CID 117347761
1-methoxy-3-[4-(4-methoxyphenyl)phenyl]benzene
CID 25138852
1-[3-(3-chlorophenyl)phenyl]cyclopropan-1-amine;hydrochloride
CID 167713457
1-methoxy-4-[3-(3-methoxyphenyl)phenyl]benzene
CID 66934064
1-[3-[3-(trifluoromethoxy)phenyl]phenyl]cyclopropan-1-amine;hydrochloride
CID 167713453
1-(3-methoxyphenyl)-3,3-dimethylcyclopentan-1-amine
CID 80692869
3-fluoro-1-(3-methoxyphenyl)-3-methylcyclopentan-1-amine
CID 115034038
1-[3-(dimethoxymethyl)phenyl]cyclopropan-1-amine
CID 84779678
1-[3-(3-methoxyphenyl)phenyl]-N-methylcyclopropan-1-amine
CID 172875841
1-[3-(2-methoxyethoxy)phenyl]cyclopropan-1-amine
CID 165348196

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine?
The IUPAC name of 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine (CID 167713468) is 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine?
The canonical SMILES for 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine is COc1ccc(-c2cccc(C3(N)CC3)c2)cc1.
What is the InChIKey of 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine?
The InChIKey is CEYMDHIACPDABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c1-18-15-7-5-12(6-8-15)13-3-2-4-14(11-13)16(17)9-10-16/h2-8,11H,9-10,17H2,1H3.
What are the key properties of 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine?
1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine has a molecular weight of 239.32 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-methoxyphenyl)phenyl]cyclopropan-1-amine is sourced from PubChem (CID 167713468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).