2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine

C19H31NO — CID 104663485

IUPAC2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine
SMILESCCCOc1ccccc1C1CCCC1CNCC(C)C
InChIInChI=1S/C19H31NO/c1-4-12-21-19-11-6-5-9-18(19)17-10-7-8-16(17)14-20-13-15(2)3/h5-6,9,11,15-17,20H,4,7-8,10,12-14H2,1-3H3
InChIKeyRQJYNUTZJZKDHK-UHFFFAOYSA-N
MW289.46 g/mol
LogP4.60
Rot. Bonds8

About 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine

2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine (PubChem CID 104663485) has the molecular formula C19H31NO and a molecular weight of 289.46 g/mol. Its IUPAC name is 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine
PubChem CID104663485
Molecular FormulaC19H31NO
Molecular Weight289.46 g/mol
Exact Mass289.24
IUPAC Name2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine
SMILESCCCOc1ccccc1C1CCCC1CNCC(C)C
InChIInChI=1S/C19H31NO/c1-4-12-21-19-11-6-5-9-18(19)17-10-7-8-16(17)14-20-13-15(2)3/h5-6,9,11,15-17,20H,4,7-8,10,12-14H2,1-3H3
InChIKeyRQJYNUTZJZKDHK-UHFFFAOYSA-N
XLogP4.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.46
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-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

N-[[2-[2-(2-methoxyethoxy)phenyl]cyclopentyl]methyl]propan-1-amine
CID 104663479
N-[[2-(2-propoxyphenyl)cyclobutyl]methyl]cyclopropanamine
CID 104663455
2-(2-propoxyphenyl)-N-propylcyclopentan-1-amine
CID 104662479
1-[2-(2-ethoxyphenyl)cyclohexyl]-N-methylmethanamine
CID 81028262
N-[[2-(2,4-difluorophenyl)cyclopentyl]methyl]-2-methylpropan-1-amine
CID 81028770
2-methyl-N-[[2-(4-propoxyphenyl)cyclobutyl]methyl]propan-1-amine
CID 81023460
1-chloro-2-(2-propoxyphenyl)cycloheptane
CID 104662441
2-(2-propoxyphenyl)cyclopentane-1-carboxylic acid
CID 104663378
2-methyl-N-[(2-naphthalen-1-ylcyclobutyl)methyl]propan-1-amine
CID 81022663
N-[[2-(2,6-difluorophenyl)cyclopentyl]methyl]-2-methylpropan-1-amine
CID 81027831
N-methyl-1-[2-(2-propan-2-yloxyphenyl)cyclohexyl]methanamine
CID 81027950
2-methyl-N-[[2-(4-propoxyphenyl)cyclopropyl]methyl]propan-1-amine
CID 55210303

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine (CID 104663485) is 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine is CCCOc1ccccc1C1CCCC1CNCC(C)C.
What is the InChIKey of 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine?
The InChIKey is RQJYNUTZJZKDHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31NO/c1-4-12-21-19-11-6-5-9-18(19)17-10-7-8-16(17)14-20-13-15(2)3/h5-6,9,11,15-17,20H,4,7-8,10,12-14H2,1-3H3.
What are the key properties of 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine?
2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine has a molecular weight of 289.46 g/mol, XLogP of 4.60, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-(2-propoxyphenyl)cyclopentyl]methyl]propan-1-amine is sourced from PubChem (CID 104663485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).