N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

C16H14ClN5O — CID 167817917

IUPACN-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESO=C(Nc1ccc2cc(Cl)cnc2n1)c1cnc2n1CCCC2
InChIInChI=1S/C16H14ClN5O/c17-11-7-10-4-5-13(20-15(10)19-8-11)21-16(23)12-9-18-14-3-1-2-6-22(12)14/h4-5,7-9H,1-3,6H2,(H,19,20,21,23)
InChIKeyXTRKGBVYETZABF-UHFFFAOYSA-N
MW327.78 g/mol
LogP3.07
Rot. Bonds2

About N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 167817917) has the molecular formula C16H14ClN5O and a molecular weight of 327.78 g/mol. Its IUPAC name is N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID167817917
Molecular FormulaC16H14ClN5O
Molecular Weight327.78 g/mol
Exact Mass327.09
IUPAC NameN-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESO=C(Nc1ccc2cc(Cl)cnc2n1)c1cnc2n1CCCC2
InChIInChI=1S/C16H14ClN5O/c17-11-7-10-4-5-13(20-15(10)19-8-11)21-16(23)12-9-18-14-3-1-2-6-22(12)14/h4-5,7-9H,1-3,6H2,(H,19,20,21,23)
InChIKeyXTRKGBVYETZABF-UHFFFAOYSA-N
XLogP3.07
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.78
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(6-chloro-1,8-naphthyridin-2-yl)-3,3-difluorocyclobutane-1-carboxamide
CID 167816475
N-(2-pyrrolidin-1-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
CID 71844938
N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
CID 136567294
N-[4-(1,2-oxazol-3-yl)phenyl]-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine-3-carboxamide
CID 136566754
1-N'-(6-chloro-1,8-naphthyridin-2-yl)-1-N-cyclopropylcyclopropane-1,1-dicarboxamide
CID 136556713
6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine-3-carboxylic acid;hydrochloride
CID 126796932
2-[3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carbonylamino)phenoxy]acetic acid
CID 136574677
2,4,6-trichloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)benzamide
CID 139013457
N-[1-[2-(6-chloronaphthalen-2-yl)sulfonylpropanoyl]piperidin-4-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
CID 140560089
N-[[4-(methoxymethyl)phenyl]methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
CID 136517116
N-(5-ethyl-1,3-oxazol-2-yl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine-3-carboxamide
CID 154789822
2-[4-[(6-chloro-1,8-naphthyridin-2-yl)amino]piperidin-1-yl]-N-methylacetamide
CID 167879235

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (CID 167817917) is N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is O=C(Nc1ccc2cc(Cl)cnc2n1)c1cnc2n1CCCC2.
What is the InChIKey of N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is XTRKGBVYETZABF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN5O/c17-11-7-10-4-5-13(20-15(10)19-8-11)21-16(23)12-9-18-14-3-1-2-6-22(12)14/h4-5,7-9H,1-3,6H2,(H,19,20,21,23).
What are the key properties of N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 327.78 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 167817917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).