phenyl(3H-pyrrol-2-yl)methanol

C11H11NO — CID 23565366

IUPACphenyl(3H-pyrrol-2-yl)methanol
SMILESOC(C1=NC=CC1)c1ccccc1
InChIInChI=1S/C11H11NO/c13-11(10-7-4-8-12-10)9-5-2-1-3-6-9/h1-6,8,11,13H,7H2
InChIKeyKYJSBBNGZFZRSS-UHFFFAOYSA-N
MW173.22 g/mol
LogP2.08
Rot. Bonds2

About phenyl(3H-pyrrol-2-yl)methanol

phenyl(3H-pyrrol-2-yl)methanol (PubChem CID 23565366) has the molecular formula C11H11NO and a molecular weight of 173.22 g/mol. Its IUPAC name is phenyl(3H-pyrrol-2-yl)methanol.

Molecular Properties

Compound Namephenyl(3H-pyrrol-2-yl)methanol
PubChem CID23565366
Molecular FormulaC11H11NO
Molecular Weight173.22 g/mol
Exact Mass173.08
IUPAC Namephenyl(3H-pyrrol-2-yl)methanol
SMILESOC(C1=NC=CC1)c1ccccc1
InChIInChI=1S/C11H11NO/c13-11(10-7-4-8-12-10)9-5-2-1-3-6-9/h1-6,8,11,13H,7H2
InChIKeyKYJSBBNGZFZRSS-UHFFFAOYSA-N
XLogP2.08
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 132005800
9-Fluoro-6-methyl-4,11-dihydrophosphinolino[3,2-b]azepin-11-ol
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Frequently Asked Questions

What is the IUPAC name of phenyl(3H-pyrrol-2-yl)methanol?
The IUPAC name of phenyl(3H-pyrrol-2-yl)methanol (CID 23565366) is phenyl(3H-pyrrol-2-yl)methanol.
What is the SMILES notation for phenyl(3H-pyrrol-2-yl)methanol?
The canonical SMILES for phenyl(3H-pyrrol-2-yl)methanol is OC(C1=NC=CC1)c1ccccc1.
What is the InChIKey of phenyl(3H-pyrrol-2-yl)methanol?
The InChIKey is KYJSBBNGZFZRSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c13-11(10-7-4-8-12-10)9-5-2-1-3-6-9/h1-6,8,11,13H,7H2.
What are the key properties of phenyl(3H-pyrrol-2-yl)methanol?
phenyl(3H-pyrrol-2-yl)methanol has a molecular weight of 173.22 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(3H-pyrrol-2-yl)methanol is sourced from PubChem (CID 23565366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).