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

C16H25NO2 — CID 43489527

IUPACN-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine
SMILESCCNC(c1cc(OC)ccc1OC)C1CCCC1
InChIInChI=1S/C16H25NO2/c1-4-17-16(12-7-5-6-8-12)14-11-13(18-2)9-10-15(14)19-3/h9-12,16-17H,4-8H2,1-3H3
InChIKeyCAZQZOKZWKVIKQ-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.54
Rot. Bonds6

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

N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine (PubChem CID 43489527) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine
PubChem CID43489527
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine
SMILESCCNC(c1cc(OC)ccc1OC)C1CCCC1
InChIInChI=1S/C16H25NO2/c1-4-17-16(12-7-5-6-8-12)14-11-13(18-2)9-10-15(14)19-3/h9-12,16-17H,4-8H2,1-3H3
InChIKeyCAZQZOKZWKVIKQ-UHFFFAOYSA-N
XLogP3.54
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine 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-[cyclooctyl-(2-methoxy-5-methylphenyl)methyl]ethanamine
CID 65018169
N-[(2-bromo-4-methoxyphenyl)-cyclohexylmethyl]ethanamine
CID 60787800
N-[cycloheptyl-(2-fluoro-4-methoxyphenyl)methyl]ethanamine
CID 63503561
N-[(2,5-dimethoxyphenyl)-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine
CID 66478019
N-[cyclohexyl-(2,4-dimethoxyphenyl)methyl]propan-1-amine
CID 43496062
2-[cyclohexyl-(2,5-dimethoxyphenyl)methyl]-1,4-dimethoxybenzene
CID 70442578
N-[cycloheptyl-(3,4-dimethoxyphenyl)methyl]ethanamine
CID 62587576
N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine
CID 60797775
N-[(2,5-dimethoxyphenyl)-(1,4-dithian-2-yl)methyl]ethanamine
CID 79966705
N-[cycloheptyl-(2-methoxy-5-methylphenyl)methyl]propan-1-amine
CID 63501845
N-cyclopentyl-1-(2,5-dimethoxyphenyl)ethane-1,2-diamine
CID 65382888
N-[cycloheptyl-(3-methoxy-4-methylphenyl)methyl]ethanamine
CID 105027735

Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine?
The IUPAC name of N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine (CID 43489527) is N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine.
What is the SMILES notation for N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine?
The canonical SMILES for N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine is CCNC(c1cc(OC)ccc1OC)C1CCCC1.
What is the InChIKey of N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine?
The InChIKey is CAZQZOKZWKVIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-4-17-16(12-7-5-6-8-12)14-11-13(18-2)9-10-15(14)19-3/h9-12,16-17H,4-8H2,1-3H3.
What are the key properties of N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine?
N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine has a molecular weight of 263.38 g/mol, XLogP of 3.54, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl-(2,5-dimethoxyphenyl)methyl]ethanamine is sourced from PubChem (CID 43489527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).