(3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone

C18H15ClN4O2 — CID 164697931

IUPAC(3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
SMILESO=C(c1ccncc1Cl)N1Cc2[nH]cnc2C(c2cccc(O)c2)C1
InChIInChI=1S/C18H15ClN4O2/c19-15-7-20-5-4-13(15)18(25)23-8-14(11-2-1-3-12(24)6-11)17-16(9-23)21-10-22-17/h1-7,10,14,24H,8-9H2,(H,21,22)
InChIKeyNZSVYFKLOURZQJ-UHFFFAOYSA-N
MW354.80 g/mol
LogP2.95
Rot. Bonds2

About (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone

(3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone (PubChem CID 164697931) has the molecular formula C18H15ClN4O2 and a molecular weight of 354.80 g/mol. Its IUPAC name is (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone.

Molecular Properties

Compound Name(3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
PubChem CID164697931
Molecular FormulaC18H15ClN4O2
Molecular Weight354.80 g/mol
Exact Mass354.09
IUPAC Name(3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
SMILESO=C(c1ccncc1Cl)N1Cc2[nH]cnc2C(c2cccc(O)c2)C1
InChIInChI=1S/C18H15ClN4O2/c19-15-7-20-5-4-13(15)18(25)23-8-14(11-2-1-3-12(24)6-11)17-16(9-23)21-10-22-17/h1-7,10,14,24H,8-9H2,(H,21,22)
InChIKeyNZSVYFKLOURZQJ-UHFFFAOYSA-N
XLogP2.95
TPSA82.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.80
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?
The IUPAC name of (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone (CID 164697931) is (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone.
What is the SMILES notation for (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?
The canonical SMILES for (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone is O=C(c1ccncc1Cl)N1Cc2[nH]cnc2C(c2cccc(O)c2)C1.
What is the InChIKey of (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?
The InChIKey is NZSVYFKLOURZQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN4O2/c19-15-7-20-5-4-13(15)18(25)23-8-14(11-2-1-3-12(24)6-11)17-16(9-23)21-10-22-17/h1-7,10,14,24H,8-9H2,(H,21,22).
What are the key properties of (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?
(3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone has a molecular weight of 354.80 g/mol, XLogP of 2.95, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-4-pyridinyl)-[7-(3-hydroxyphenyl)-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone is sourced from PubChem (CID 164697931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).