[1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine

C19H29NO2 — CID 117488616

IUPAC[1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine
SMILESCOc1ccc(C2(CN)CCCCC2)cc1OC1CCCC1
InChIInChI=1S/C19H29NO2/c1-21-17-10-9-15(19(14-20)11-5-2-6-12-19)13-18(17)22-16-7-3-4-8-16/h9-10,13,16H,2-8,11-12,14,20H2,1H3
InChIKeyRNNAGDUFFRWZKL-UHFFFAOYSA-N
MW303.45 g/mol
LogP4.18
Rot. Bonds5

About [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine

[1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine (PubChem CID 117488616) has the molecular formula C19H29NO2 and a molecular weight of 303.45 g/mol. Its IUPAC name is [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine
PubChem CID117488616
Molecular FormulaC19H29NO2
Molecular Weight303.45 g/mol
Exact Mass303.22
IUPAC Name[1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine
SMILESCOc1ccc(C2(CN)CCCCC2)cc1OC1CCCC1
InChIInChI=1S/C19H29NO2/c1-21-17-10-9-15(19(14-20)11-5-2-6-12-19)13-18(17)22-16-7-3-4-8-16/h9-10,13,16H,2-8,11-12,14,20H2,1H3
InChIKeyRNNAGDUFFRWZKL-UHFFFAOYSA-N
XLogP4.18
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]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

[1-[3-methoxy-4-(oxan-3-yloxy)phenyl]cyclobutyl]methanamine
CID 117470732
3-(3-cyclopentyloxy-4-methoxyphenyl)-3-(hydroxymethyl)cyclobutan-1-one
CID 23298807
[1-(3-chloro-4-methoxyphenyl)cyclohexyl]methanamine
CID 82499570
1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexane-1-carboxylic acid
CID 19976886
1-(3-cyclopentyloxy-4-methoxyphenyl)cyclopentane-1-carbonitrile
CID 154535456
[1-(4-cyclobutyloxyphenyl)cyclohexyl]methanamine
CID 117402976
[1-(4-methoxy-3-methylsulfanylphenyl)cyclohexyl]methanamine
CID 117418161
[1-[4-(cyclopropylmethoxy)-3-methoxyphenyl]cyclobutyl]methanamine
CID 117408013
[1-[3-methoxy-4-(methoxymethyl)phenyl]cyclopentyl]methanamine
CID 117377424
[1-(3-methoxy-4-propan-2-ylphenyl)cyclopentyl]methanamine
CID 117371885
2-[1-(4-cyclopentyloxy-3-methoxyphenyl)cyclopropyl]acetic acid
CID 117469213
[1-(3-fluoro-4-methoxyphenyl)cyclobutyl]methanamine
CID 131328420

Frequently Asked Questions

What is the IUPAC name of [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine?
The IUPAC name of [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine (CID 117488616) is [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine?
The canonical SMILES for [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine is COc1ccc(C2(CN)CCCCC2)cc1OC1CCCC1.
What is the InChIKey of [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine?
The InChIKey is RNNAGDUFFRWZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO2/c1-21-17-10-9-15(19(14-20)11-5-2-6-12-19)13-18(17)22-16-7-3-4-8-16/h9-10,13,16H,2-8,11-12,14,20H2,1H3.
What are the key properties of [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine?
[1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine has a molecular weight of 303.45 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexyl]methanamine is sourced from PubChem (CID 117488616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).