[5-(cyclopentylamino)-2-methoxyphenyl]methanol

C13H19NO2 — CID 115744113

IUPAC[5-(cyclopentylamino)-2-methoxyphenyl]methanol
SMILESCOc1ccc(NC2CCCC2)cc1CO
InChIInChI=1S/C13H19NO2/c1-16-13-7-6-12(8-10(13)9-15)14-11-4-2-3-5-11/h6-8,11,14-15H,2-5,9H2,1H3
InChIKeyUSNCGNSXKSPZLU-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.54
Rot. Bonds4

About [5-(cyclopentylamino)-2-methoxyphenyl]methanol

[5-(cyclopentylamino)-2-methoxyphenyl]methanol (PubChem CID 115744113) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is [5-(cyclopentylamino)-2-methoxyphenyl]methanol.

Molecular Properties

Compound Name[5-(cyclopentylamino)-2-methoxyphenyl]methanol
PubChem CID115744113
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name[5-(cyclopentylamino)-2-methoxyphenyl]methanol
SMILESCOc1ccc(NC2CCCC2)cc1CO
InChIInChI=1S/C13H19NO2/c1-16-13-7-6-12(8-10(13)9-15)14-11-4-2-3-5-11/h6-8,11,14-15H,2-5,9H2,1H3
InChIKeyUSNCGNSXKSPZLU-UHFFFAOYSA-N
XLogP2.54
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

4-[4-ethoxy-3-(hydroxymethyl)anilino]cyclohexan-1-ol
CID 106594412
N-cyclopentyl-3-ethoxy-4-methoxyaniline
CID 43729865
4-(3-ethyl-4-methoxyanilino)cyclohexan-1-ol
CID 115149340
3-bromo-N-cyclopentyl-4-methoxyaniline
CID 63999867
[2-ethoxy-5-[(4-propan-2-ylcyclohexyl)amino]phenyl]methanol
CID 62708979
N-(3-fluoro-4-methoxyphenyl)cycloheptanamine
CID 43380636
[2-ethoxy-5-[(3-methylcyclopentyl)amino]phenyl]methanol
CID 64500267
N-(4-bromo-3-methoxyphenyl)cycloheptanamine
CID 82858294
4-N-cyclooctyl-2-methoxybenzene-1,4-diamine
CID 63672291
[2-ethoxy-5-(pyrrolidin-3-ylamino)phenyl]methanol
CID 79730547
N-[3-(hydroxymethyl)-4-methoxyphenyl]acetamide
CID 82469130
4-(cycloheptylamino)-2-methoxybenzoic acid
CID 107209609

Frequently Asked Questions

What is the IUPAC name of [5-(cyclopentylamino)-2-methoxyphenyl]methanol?
The IUPAC name of [5-(cyclopentylamino)-2-methoxyphenyl]methanol (CID 115744113) is [5-(cyclopentylamino)-2-methoxyphenyl]methanol.
What is the SMILES notation for [5-(cyclopentylamino)-2-methoxyphenyl]methanol?
The canonical SMILES for [5-(cyclopentylamino)-2-methoxyphenyl]methanol is COc1ccc(NC2CCCC2)cc1CO.
What is the InChIKey of [5-(cyclopentylamino)-2-methoxyphenyl]methanol?
The InChIKey is USNCGNSXKSPZLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-16-13-7-6-12(8-10(13)9-15)14-11-4-2-3-5-11/h6-8,11,14-15H,2-5,9H2,1H3.
What are the key properties of [5-(cyclopentylamino)-2-methoxyphenyl]methanol?
[5-(cyclopentylamino)-2-methoxyphenyl]methanol has a molecular weight of 221.30 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(cyclopentylamino)-2-methoxyphenyl]methanol is sourced from PubChem (CID 115744113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).