4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol

C13H19NO2 — CID 61056997

IUPAC4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol
SMILESOCC(NC1CCCC1)c1ccc(O)cc1
InChIInChI=1S/C13H19NO2/c15-9-13(14-11-3-1-2-4-11)10-5-7-12(16)8-6-10/h5-8,11,13-16H,1-4,9H2
InChIKeyBYXAAFDJYFMASF-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.96
Rot. Bonds4

About 4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol

4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol (PubChem CID 61056997) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol.

Molecular Properties

Compound Name4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol
PubChem CID61056997
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol
SMILESOCC(NC1CCCC1)c1ccc(O)cc1
InChIInChI=1S/C13H19NO2/c15-9-13(14-11-3-1-2-4-11)10-5-7-12(16)8-6-10/h5-8,11,13-16H,1-4,9H2
InChIKeyBYXAAFDJYFMASF-UHFFFAOYSA-N
XLogP1.96
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopentylamino)-2-[4-(trifluoromethylsulfanyl)phenyl]ethanol
CID 61055172
2-(cyclopropylamino)-2-[4-(difluoromethyl)phenyl]ethanol
CID 115525129
(2S)-2-(cyclopropylamino)-2-phenylethanol
CID 93471499
2-(cycloheptylamino)-2-(3,4-dimethylphenyl)ethanol
CID 61055162
2-(4-bromo-3-chlorophenyl)-2-(cyclopentylamino)ethanol
CID 114077187
4-[1-(cycloheptylamino)-2-hydroxyethyl]-2-ethoxyphenol
CID 61054148
2-(3-chloro-4-fluorophenyl)-2-(cycloheptylamino)ethanol
CID 81165963
2-(cyclopropylamino)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
CID 82289327
2-(cycloheptylamino)-2-(4-methoxy-3-methylphenyl)ethanol
CID 62132634
2-(cyclopentylamino)-2-(5-methylthiophen-2-yl)ethanol
CID 61345205
4-[1-(cyclopropylamino)-2-hydroxyethyl]-2-fluorophenol
CID 107693474
2-(cyclohexylamino)-2-(3-ethoxyphenyl)ethanol
CID 61047485

Frequently Asked Questions

What is the IUPAC name of 4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol?
The IUPAC name of 4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol (CID 61056997) is 4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol.
What is the SMILES notation for 4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol?
The canonical SMILES for 4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol is OCC(NC1CCCC1)c1ccc(O)cc1.
What is the InChIKey of 4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol?
The InChIKey is BYXAAFDJYFMASF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c15-9-13(14-11-3-1-2-4-11)10-5-7-12(16)8-6-10/h5-8,11,13-16H,1-4,9H2.
What are the key properties of 4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol?
4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol has a molecular weight of 221.30 g/mol, XLogP of 1.96, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(cyclopentylamino)-2-hydroxyethyl]phenol is sourced from PubChem (CID 61056997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).