2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine

C15H22ClNO2 — CID 117456580

IUPAC2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine
SMILESCNCCc1c(Cl)ccc(OC)c1OC1CCCC1
InChIInChI=1S/C15H22ClNO2/c1-17-10-9-12-13(16)7-8-14(18-2)15(12)19-11-5-3-4-6-11/h7-8,11,17H,3-6,9-10H2,1-2H3
InChIKeyWLCCJKYFCYRYBS-UHFFFAOYSA-N
MW283.80 g/mol
LogP3.43
Rot. Bonds6

About 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine

2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine (PubChem CID 117456580) has the molecular formula C15H22ClNO2 and a molecular weight of 283.80 g/mol. Its IUPAC name is 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine.

Molecular Properties

Compound Name2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine
PubChem CID117456580
Molecular FormulaC15H22ClNO2
Molecular Weight283.80 g/mol
Exact Mass283.13
IUPAC Name2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine
SMILESCNCCc1c(Cl)ccc(OC)c1OC1CCCC1
InChIInChI=1S/C15H22ClNO2/c1-17-10-9-12-13(16)7-8-14(18-2)15(12)19-11-5-3-4-6-11/h7-8,11,17H,3-6,9-10H2,1-2H3
InChIKeyWLCCJKYFCYRYBS-UHFFFAOYSA-N
XLogP3.43
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine 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-amino-2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)ethanol
CID 117460411
2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-2-oxoacetic acid
CID 117481112
1,3-dichloro-2-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]benzene
CID 21221257
2-(2-chloro-6-methoxyphenyl)-N-methylethanamine
CID 84669164
1-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)cyclopentan-1-amine
CID 117494434
7-cyclopentyloxy-N-[(2,6-dichlorophenyl)methyl]-6-methoxy-1-benzofuran-3-amine
CID 24958044
2-chloro-4-cyclobutyloxy-1-methoxybenzene
CID 130057041
2-[3-methoxy-4-(oxan-3-yloxy)phenyl]-N-methylethanamine
CID 117417850
5-cyclopentyloxy-1-[(3,5-dichloro-4-pyridinyl)methyl]-6-methoxy-3-oxidophthalazin-3-ium
CID 18504826
[2-(chloromethyl)-6-methoxyphenoxy]cycloheptane
CID 82927927
3-cyclopentyloxy-2-fluoro-4-methoxyphenol
CID 125116751
2-cyclopentyloxy-1-ethyl-3-methoxybenzene
CID 90711986

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine?
The IUPAC name of 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine (CID 117456580) is 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine.
What is the SMILES notation for 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine?
The canonical SMILES for 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine is CNCCc1c(Cl)ccc(OC)c1OC1CCCC1.
What is the InChIKey of 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine?
The InChIKey is WLCCJKYFCYRYBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO2/c1-17-10-9-12-13(16)7-8-14(18-2)15(12)19-11-5-3-4-6-11/h7-8,11,17H,3-6,9-10H2,1-2H3.
What are the key properties of 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine?
2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine has a molecular weight of 283.80 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-2-cyclopentyloxy-3-methoxyphenyl)-N-methylethanamine is sourced from PubChem (CID 117456580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).