[2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol

C15H23NO3 — CID 103700479

IUPAC[2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol
SMILESCOc1ccc(CNC2CCCC2CO)c(OC)c1
InChIInChI=1S/C15H23NO3/c1-18-13-7-6-11(15(8-13)19-2)9-16-14-5-3-4-12(14)10-17/h6-8,12,14,16-17H,3-5,9-10H2,1-2H3
InChIKeyZAWPWYIDIDUHJM-UHFFFAOYSA-N
MW265.35 g/mol
LogP1.95
Rot. Bonds6

About [2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol

[2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol (PubChem CID 103700479) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is [2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol
PubChem CID103700479
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name[2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol
SMILESCOc1ccc(CNC2CCCC2CO)c(OC)c1
InChIInChI=1S/C15H23NO3/c1-18-13-7-6-11(15(8-13)19-2)9-16-14-5-3-4-12(14)10-17/h6-8,12,14,16-17H,3-5,9-10H2,1-2H3
InChIKeyZAWPWYIDIDUHJM-UHFFFAOYSA-N
XLogP1.95
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2,4-dimethoxyphenyl)methylamino]cyclohexan-1-ol
CID 62365081
N-[(2,4-dimethoxyphenyl)methyl]-2,3-dimethylcyclohexan-1-amine
CID 43082086
N-[(2,4-dimethoxyphenyl)methyl]-2-methylcyclohexan-1-amine
CID 2852810
N-[(2,4-dimethoxyphenyl)methyl]cyclododecanamine;hydrochloride
CID 21435442
N-[2-(hydroxymethyl)cyclopentyl]-2,4-dimethoxybenzenesulfonamide
CID 103835940
[2-[(3-fluoro-4-methoxyphenyl)methylamino]cyclopentyl]methanol
CID 103700320
[2-[(2-fluoro-3-methoxyphenyl)methylamino]cyclohexyl]methanol
CID 106361157
(2S,3S)-N-[(2,4-dimethoxyphenyl)methyl]-2-phenylpiperidin-3-amine
CID 54042536
2-ethyl-N-[(2-fluoro-4-methoxyphenyl)methyl]cyclohexan-1-amine
CID 102876314
[2-[(2-propan-2-yloxyphenyl)methylamino]cyclopentyl]methanol
CID 103700313
N-cyclopentyloxy-1-(2,4-dimethoxyphenyl)methanamine
CID 83228718
[2-[(4-fluoro-2-methylphenyl)methylamino]cyclopentyl]methanol
CID 113243356

Frequently Asked Questions

What is the IUPAC name of [2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol?
The IUPAC name of [2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol (CID 103700479) is [2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol.
What is the SMILES notation for [2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol?
The canonical SMILES for [2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol is COc1ccc(CNC2CCCC2CO)c(OC)c1.
What is the InChIKey of [2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol?
The InChIKey is ZAWPWYIDIDUHJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-18-13-7-6-11(15(8-13)19-2)9-16-14-5-3-4-12(14)10-17/h6-8,12,14,16-17H,3-5,9-10H2,1-2H3.
What are the key properties of [2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol?
[2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol has a molecular weight of 265.35 g/mol, XLogP of 1.95, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2,4-dimethoxyphenyl)methylamino]cyclopentyl]methanol is sourced from PubChem (CID 103700479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).