N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine

C17H25NO2 — CID 81033094

IUPACN-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine
SMILESCOc1ccc(OC)c(C2CCCC2CNC2CC2)c1
InChIInChI=1S/C17H25NO2/c1-19-14-8-9-17(20-2)16(10-14)15-5-3-4-12(15)11-18-13-6-7-13/h8-10,12-13,15,18H,3-7,11H2,1-2H3
InChIKeySUUYLBIHOKBZQO-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.34
Rot. Bonds6

About N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine

N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine (PubChem CID 81033094) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine
PubChem CID81033094
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine
SMILESCOc1ccc(OC)c(C2CCCC2CNC2CC2)c1
InChIInChI=1S/C17H25NO2/c1-19-14-8-9-17(20-2)16(10-14)15-5-3-4-12(15)11-18-13-6-7-13/h8-10,12-13,15,18H,3-7,11H2,1-2H3
InChIKeySUUYLBIHOKBZQO-UHFFFAOYSA-N
XLogP3.34
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine 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

N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]propan-1-amine
CID 81033055
N-[[2-(2,5-dimethoxyphenyl)cyclohexyl]methyl]ethanamine
CID 81027759
2-[2-(2,5-dimethoxyphenyl)cyclopentyl]acetic acid
CID 66652406
N-[[2-(2,5-dimethoxyphenyl)cyclobutyl]methyl]-2-methylpropan-2-amine
CID 81023713
N-[[2-(2,4-dimethoxyphenyl)oxan-3-yl]methyl]cyclopropanamine
CID 79370940
trans-(1R,2S)-2-(2,5-dimethoxyphenyl)cyclohexan-1-ol
CID 6994758
1-[(1R,2S)-2-(2,5-dimethoxyphenyl)cyclopropyl]-N-methylmethanamine
CID 94558417
N-[(2,5-dimethoxyphenyl)methyl]cyclopropanamine;hydrochloride
CID 167726962
N-[[2-(4-ethoxyphenyl)cyclopentyl]methyl]cyclopropanamine
CID 81034354
1-[2-(4-methoxy-2-methylphenyl)cyclohexyl]-N-methylmethanamine
CID 81027952
N-[[2-(4-fluoro-2-methylphenyl)cyclopentyl]methyl]cyclopropanamine
CID 81032761
N-[(2,5-dimethoxyphenyl)methyl]cyclopentanamine
CID 792687

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine (CID 81033094) is N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine is COc1ccc(OC)c(C2CCCC2CNC2CC2)c1.
What is the InChIKey of N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine?
The InChIKey is SUUYLBIHOKBZQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-19-14-8-9-17(20-2)16(10-14)15-5-3-4-12(15)11-18-13-6-7-13/h8-10,12-13,15,18H,3-7,11H2,1-2H3.
What are the key properties of N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine?
N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine has a molecular weight of 275.39 g/mol, XLogP of 3.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,5-dimethoxyphenyl)cyclopentyl]methyl]cyclopropanamine is sourced from PubChem (CID 81033094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).