(4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone

C15H12N2O2 — CID 164867644

IUPAC(4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone
SMILESCn1cc(C(=O)c2ccc(O)cc2)c2ccncc21
InChIInChI=1S/C15H12N2O2/c1-17-9-13(12-6-7-16-8-14(12)17)15(19)10-2-4-11(18)5-3-10/h2-9,18H,1H3
InChIKeyRPGYCYNHKLNFKU-UHFFFAOYSA-N
MW252.27 g/mol
LogP2.51
Rot. Bonds2

About (4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone

(4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone (PubChem CID 164867644) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is (4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone.

Molecular Properties

Compound Name(4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone
PubChem CID164867644
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name(4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone
SMILESCn1cc(C(=O)c2ccc(O)cc2)c2ccncc21
InChIInChI=1S/C15H12N2O2/c1-17-9-13(12-6-7-16-8-14(12)17)15(19)10-2-4-11(18)5-3-10/h2-9,18H,1H3
InChIKeyRPGYCYNHKLNFKU-UHFFFAOYSA-N
XLogP2.51
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone?
The IUPAC name of (4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone (CID 164867644) is (4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone.
What is the SMILES notation for (4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone?
The canonical SMILES for (4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone is Cn1cc(C(=O)c2ccc(O)cc2)c2ccncc21.
What is the InChIKey of (4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone?
The InChIKey is RPGYCYNHKLNFKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c1-17-9-13(12-6-7-16-8-14(12)17)15(19)10-2-4-11(18)5-3-10/h2-9,18H,1H3.
What are the key properties of (4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone?
(4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone has a molecular weight of 252.27 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxyphenyl)-(1-methylpyrrolo[2,3-c]pyridin-3-yl)methanone is sourced from PubChem (CID 164867644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).