N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide

C14H10ClN5O — CID 6900980

IUPACN-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide
SMILESO=C(N/N=C/c1c(Cl)nc2ccccn12)c1ccncc1
InChIInChI=1S/C14H10ClN5O/c15-13-11(20-8-2-1-3-12(20)18-13)9-17-19-14(21)10-4-6-16-7-5-10/h1-9H,(H,19,21)/b17-9+
InChIKeySNWOLVPTIDFADT-RQZCQDPDSA-N
MW299.72 g/mol
LogP2.15
Rot. Bonds3

About N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide

N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide (PubChem CID 6900980) has the molecular formula C14H10ClN5O and a molecular weight of 299.72 g/mol. Its IUPAC name is N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide
PubChem CID6900980
Molecular FormulaC14H10ClN5O
Molecular Weight299.72 g/mol
Exact Mass299.06
IUPAC NameN-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide
SMILESO=C(N/N=C/c1c(Cl)nc2ccccn12)c1ccncc1
InChIInChI=1S/C14H10ClN5O/c15-13-11(20-8-2-1-3-12(20)18-13)9-17-19-14(21)10-4-6-16-7-5-10/h1-9H,(H,19,21)/b17-9+
InChIKeySNWOLVPTIDFADT-RQZCQDPDSA-N
XLogP2.15
TPSA71.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.72
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide
CID 2333321
[(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]urea
CID 75207260
N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]-2,4-dioxo-1H-pyrimidine-6-carboxamide
CID 6899895
N-[4-[1-[[(E)-3-(2-chloroimidazo[1,2-a]pyridin-3-yl)prop-2-enoyl]amino]ethyl]phenyl]pyridine-4-carboxamide
CID 86948427
N-[[4-[(pyridine-4-carbonylhydrazinylidene)methyl]phenyl]methylideneamino]pyridine-4-carboxamide
CID 1101714
[(Z)-(2-methylimidazo[1,2-a]pyridin-3-yl)methylideneamino]urea
CID 6215773
N-[(E)-(4-chlorophenyl)methylideneamino]pyridine-4-carboxamide;hydrate
CID 21204570
N-[(E)-[4-oxo-2-(1-phenyltetrazol-5-yl)sulfanylpyrido[1,2-a]pyrimidin-3-yl]methylideneamino]pyridine-4-carboxamide
CID 6899307
N-[(2-methylphenyl)methylideneamino]pyridine-4-carboxamide
CID 690992
N-[(E)-[1-(2-chlorophenyl)triazol-4-yl]methylideneamino]pyridine-4-carboxamide
CID 53474279
N-[[4-(N-methylanilino)phenyl]methylideneamino]pyridine-4-carboxamide
CID 5149584
2-chloro-3-(3-chloroprop-1-enyl)imidazo[1,2-a]pyridine
CID 79334490

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide?
The IUPAC name of N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide (CID 6900980) is N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide.
What is the SMILES notation for N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide?
The canonical SMILES for N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide is O=C(N/N=C/c1c(Cl)nc2ccccn12)c1ccncc1.
What is the InChIKey of N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide?
The InChIKey is SNWOLVPTIDFADT-RQZCQDPDSA-N. The full InChI is InChI=1S/C14H10ClN5O/c15-13-11(20-8-2-1-3-12(20)18-13)9-17-19-14(21)10-4-6-16-7-5-10/h1-9H,(H,19,21)/b17-9+.
What are the key properties of N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide?
N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide has a molecular weight of 299.72 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(2-chloroimidazo[1,2-a]pyridin-3-yl)methylideneamino]pyridine-4-carboxamide is sourced from PubChem (CID 6900980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).