cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine

C18H21NO — CID 4210839

IUPACcyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine
SMILESCc1cc(OCc2ccccc2)ccc1C(N)C1CC1
InChIInChI=1S/C18H21NO/c1-13-11-16(20-12-14-5-3-2-4-6-14)9-10-17(13)18(19)15-7-8-15/h2-6,9-11,15,18H,7-8,12,19H2,1H3
InChIKeyGIYCYOIGOANMAM-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.98
Rot. Bonds5

About cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine

cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine (PubChem CID 4210839) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine.

Molecular Properties

Compound Namecyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine
PubChem CID4210839
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Namecyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine
SMILESCc1cc(OCc2ccccc2)ccc1C(N)C1CC1
InChIInChI=1S/C18H21NO/c1-13-11-16(20-12-14-5-3-2-4-6-14)9-10-17(13)18(19)15-7-8-15/h2-6,9-11,15,18H,7-8,12,19H2,1H3
InChIKeyGIYCYOIGOANMAM-UHFFFAOYSA-N
XLogP3.98
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)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

2-[(R)-amino(cyclohexyl)methyl]-5-phenylmethoxyphenol;hydrochloride
CID 171214482
(S)-cyclopropyl-(4-phenylmethoxyphenyl)methanamine
CID 171230786
(R)-cyclopropyl-(4-phenylmethoxyphenyl)methanamine
CID 171211184
(1S,2R)-2-amino-1-(2-methyl-4-phenylmethoxyphenyl)propan-1-ol
CID 139820128
(S)-cyclopropyl-(4-phenylmethoxyphenyl)methanamine;hydrochloride
CID 171230787
(S)-cyclopropyl-(4,5-dimethoxy-2-phenylmethoxyphenyl)methanamine;hydrochloride
CID 171233983
(S)-cyclobutyl-(3,5-dimethyl-4-phenylmethoxyphenyl)methanamine;hydrochloride
CID 171234044
3-(2-methyl-4-phenylmethoxyphenyl)-3-pyrrolidin-1-ylpropan-1-amine
CID 83937117
(1S)-1-(2-fluoro-4-phenylmethoxyphenyl)ethanamine
CID 107718661
(S)-cyclobutyl-(2-phenylmethoxyphenyl)methanamine
CID 171233917
(S)-cyclopentyl-(2-phenylmethoxyphenyl)methanamine
CID 171233921
2-methyl-4-phenylmethoxybenzenethiol
CID 142266616

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine?
The IUPAC name of cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine (CID 4210839) is cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine.
What is the SMILES notation for cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine?
The canonical SMILES for cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine is Cc1cc(OCc2ccccc2)ccc1C(N)C1CC1.
What is the InChIKey of cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine?
The InChIKey is GIYCYOIGOANMAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-13-11-16(20-12-14-5-3-2-4-6-14)9-10-17(13)18(19)15-7-8-15/h2-6,9-11,15,18H,7-8,12,19H2,1H3.
What are the key properties of cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine?
cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine has a molecular weight of 267.37 g/mol, XLogP of 3.98, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(2-methyl-4-phenylmethoxyphenyl)methanamine is sourced from PubChem (CID 4210839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).