N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

C15H15ClFN3O2 — CID 136567294

IUPACN-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cc(Cl)c(F)cc1NC(=O)c1cnc2n1CCCC2
InChIInChI=1S/C15H15ClFN3O2/c1-22-13-6-9(16)10(17)7-11(13)19-15(21)12-8-18-14-4-2-3-5-20(12)14/h6-8H,2-5H2,1H3,(H,19,21)
InChIKeyZCFOLDUCGLAQTA-UHFFFAOYSA-N
MW323.76 g/mol
LogP3.27
Rot. Bonds3

About N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 136567294) has the molecular formula C15H15ClFN3O2 and a molecular weight of 323.76 g/mol. Its IUPAC name is N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID136567294
Molecular FormulaC15H15ClFN3O2
Molecular Weight323.76 g/mol
Exact Mass323.08
IUPAC NameN-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESCOc1cc(Cl)c(F)cc1NC(=O)c1cnc2n1CCCC2
InChIInChI=1S/C15H15ClFN3O2/c1-22-13-6-9(16)10(17)7-11(13)19-15(21)12-8-18-14-4-2-3-5-20(12)14/h6-8H,2-5H2,1H3,(H,19,21)
InChIKeyZCFOLDUCGLAQTA-UHFFFAOYSA-N
XLogP3.27
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.76
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-5-fluoro-2-methoxyphenyl)-2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxamide
CID 138021786
N-(2-pyrrolidin-1-ylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
CID 71844938
N-(4-methoxy-7-phenyl-3H-indol-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
CID 147014443
N-(6-chloro-1,8-naphthyridin-2-yl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
CID 167817917
N-[2-fluoro-5-[[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]carbamoyl]phenyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
CID 71511057
N-(4-chloro-5-fluoro-2-methoxyphenyl)-3-pyridin-3-ylpyrrolidine-1-carboxamide
CID 136564309
2,4-dichloro-5-fluoro-N-[2-methyl-5-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzamide
CID 55547668
3-chloro-N-[4-fluoro-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-4,5-dimethoxybenzamide
CID 30603699
N-(5-ethyl-1,3-oxazol-2-yl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepine-3-carboxamide
CID 154789822
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

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (CID 136567294) is N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is COc1cc(Cl)c(F)cc1NC(=O)c1cnc2n1CCCC2.
What is the InChIKey of N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is ZCFOLDUCGLAQTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClFN3O2/c1-22-13-6-9(16)10(17)7-11(13)19-15(21)12-8-18-14-4-2-3-5-20(12)14/h6-8H,2-5H2,1H3,(H,19,21).
What are the key properties of N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 323.76 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-5-fluoro-2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 136567294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).