2-(1-cyclobutyl-2-hydroxyethyl)phenol

C12H16O2 — CID 115019132

IUPAC2-(1-cyclobutyl-2-hydroxyethyl)phenol
SMILESOCC(c1ccccc1O)C1CCC1
InChIInChI=1S/C12H16O2/c13-8-11(9-4-3-5-9)10-6-1-2-7-12(10)14/h1-2,6-7,9,11,13-14H,3-5,8H2
InChIKeyYWPZGNQJKOVVME-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.27
Rot. Bonds3

About 2-(1-cyclobutyl-2-hydroxyethyl)phenol

2-(1-cyclobutyl-2-hydroxyethyl)phenol (PubChem CID 115019132) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(1-cyclobutyl-2-hydroxyethyl)phenol.

Molecular Properties

Compound Name2-(1-cyclobutyl-2-hydroxyethyl)phenol
PubChem CID115019132
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name2-(1-cyclobutyl-2-hydroxyethyl)phenol
SMILESOCC(c1ccccc1O)C1CCC1
InChIInChI=1S/C12H16O2/c13-8-11(9-4-3-5-9)10-6-1-2-7-12(10)14/h1-2,6-7,9,11,13-14H,3-5,8H2
InChIKeyYWPZGNQJKOVVME-UHFFFAOYSA-N
XLogP2.27
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 130665653
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[2-(1-cyclopentyl-2-fluoroethyl)phenyl]methanol
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2-(2-chlorophenyl)-2-(1-methylpiperidin-4-yl)ethanol
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2-(1-cyclohexyl-2,2-difluoroethyl)phenol
CID 115043682
1,5-di(cyclobutyl)-1,5-bis(2-methylphenyl)pentan-3-one
CID 73011538
2-cyclohexyl-2-(2-hydroxyphenyl)acetic acid
CID 22178850
2-(2-chlorophenyl)-2-cyclobutylethanamine
CID 83688611
2-[1-amino-3-(cyclobutylamino)propan-2-yl]phenol
CID 117243823
3-cyclopentyl-3-phenylpropan-1-ol
CID 57047034
2-[(1S)-1-amino-2-cyclopropylethyl]phenol;hydrochloride
CID 171220494
2-[(R)-amino(cyclopropyl)methyl]phenol;hydrochloride
CID 171200964

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclobutyl-2-hydroxyethyl)phenol?
The IUPAC name of 2-(1-cyclobutyl-2-hydroxyethyl)phenol (CID 115019132) is 2-(1-cyclobutyl-2-hydroxyethyl)phenol.
What is the SMILES notation for 2-(1-cyclobutyl-2-hydroxyethyl)phenol?
The canonical SMILES for 2-(1-cyclobutyl-2-hydroxyethyl)phenol is OCC(c1ccccc1O)C1CCC1.
What is the InChIKey of 2-(1-cyclobutyl-2-hydroxyethyl)phenol?
The InChIKey is YWPZGNQJKOVVME-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c13-8-11(9-4-3-5-9)10-6-1-2-7-12(10)14/h1-2,6-7,9,11,13-14H,3-5,8H2.
What are the key properties of 2-(1-cyclobutyl-2-hydroxyethyl)phenol?
2-(1-cyclobutyl-2-hydroxyethyl)phenol has a molecular weight of 192.26 g/mol, XLogP of 2.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclobutyl-2-hydroxyethyl)phenol is sourced from PubChem (CID 115019132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).