6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one

C18H11ClN8O — CID 137051623

IUPAC6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESO=c1[nH]c2cc(Cl)c(-c3ccc(-c4ccc(-n5cnnn5)nc4)cc3)nc2[nH]1
InChIInChI=1S/C18H11ClN8O/c19-13-7-14-17(24-18(28)22-14)23-16(13)11-3-1-10(2-4-11)12-5-6-15(20-8-12)27-9-21-25-26-27/h1-9H,(H2,22,23,24,28)
InChIKeyIWHVEMKJNOKOPP-UHFFFAOYSA-N
MW390.79 g/mol
LogP2.61
Rot. Bonds3

About 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one

6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one (PubChem CID 137051623) has the molecular formula C18H11ClN8O and a molecular weight of 390.79 g/mol. Its IUPAC name is 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one
PubChem CID137051623
Molecular FormulaC18H11ClN8O
Molecular Weight390.79 g/mol
Exact Mass390.07
IUPAC Name6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESO=c1[nH]c2cc(Cl)c(-c3ccc(-c4ccc(-n5cnnn5)nc4)cc3)nc2[nH]1
InChIInChI=1S/C18H11ClN8O/c19-13-7-14-17(24-18(28)22-14)23-16(13)11-3-1-10(2-4-11)12-5-6-15(20-8-12)27-9-21-25-26-27/h1-9H,(H2,22,23,24,28)
InChIKeyIWHVEMKJNOKOPP-UHFFFAOYSA-N
XLogP2.61
TPSA118.03 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.79
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one with MolForge

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Related Compounds

5-[4-[4-(1-amino-2,2,2-trifluoroethyl)phenyl]phenyl]-6-chloro-1,3-dihydroimidazo[4,5-b]pyridin-2-one
CID 138567780
6-chloro-5-[4-(2-fluorophenyl)phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one
CID 138567693
5-chloro-2-(tetrazol-1-yl)pyridine
CID 102567268
2,3-dihydroxypropyl N-[4-[4-(6-chloro-2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)phenyl]phenyl]carbamate
CID 138493993
6-chloro-5-[4-[4-(2-methylpropylsulfonyl)piperazin-1-yl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one
CID 138567655
6-chloro-5-[4-[1-(2-nitrosoacetyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one
CID 138741475
4-[4-[4-(6-chloro-2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-5-yl)phenyl]phenyl]butanoic acid;oxan-2-ylmethanol
CID 144579612
6-chloro-5-methyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
CID 144579589
N-[[(3S)-1-oxo-6-[6-(tetrazol-1-yl)-3-pyridinyl]-3a,4-dihydro-3H-[1,3]oxazolo[3,4-a]indol-3-yl]methyl]acetamide
CID 25063994
aluminum tris(6-(2-hydroxyphenyl)-5-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one)
CID 175810779
5-(5-chloro-1,2,4-triazin-6-yl)-1,3-dihydrobenzimidazol-2-one
CID 116822901
2-[6-(tetrazol-1-yl)-3-pyridinyl]ethanol
CID 67516823

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The IUPAC name of 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one (CID 137051623) is 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one is O=c1[nH]c2cc(Cl)c(-c3ccc(-c4ccc(-n5cnnn5)nc4)cc3)nc2[nH]1.
What is the InChIKey of 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The InChIKey is IWHVEMKJNOKOPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11ClN8O/c19-13-7-14-17(24-18(28)22-14)23-16(13)11-3-1-10(2-4-11)12-5-6-15(20-8-12)27-9-21-25-26-27/h1-9H,(H2,22,23,24,28).
What are the key properties of 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one has a molecular weight of 390.79 g/mol, XLogP of 2.61, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-[4-[6-(tetrazol-1-yl)-3-pyridinyl]phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 137051623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).