N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide

C23H19FN4O — CID 23120512

IUPACN-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide
SMILESCc1c(C2CC2)nc2ccc(NC(=O)c3ccc(-c4ccc(F)nc4)cc3)cn12
InChIInChI=1S/C23H19FN4O/c1-14-22(16-4-5-16)27-21-11-9-19(13-28(14)21)26-23(29)17-6-2-15(3-7-17)18-8-10-20(24)25-12-18/h2-3,6-13,16H,4-5H2,1H3,(H,26,29)
InChIKeyRDMFLPVCZMTDDR-UHFFFAOYSA-N
MW386.43 g/mol
LogP4.97
Rot. Bonds4

About N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide

N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide (PubChem CID 23120512) has the molecular formula C23H19FN4O and a molecular weight of 386.43 g/mol. Its IUPAC name is N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide.

Molecular Properties

Compound NameN-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide
PubChem CID23120512
Molecular FormulaC23H19FN4O
Molecular Weight386.43 g/mol
Exact Mass386.15
IUPAC NameN-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide
SMILESCc1c(C2CC2)nc2ccc(NC(=O)c3ccc(-c4ccc(F)nc4)cc3)cn12
InChIInChI=1S/C23H19FN4O/c1-14-22(16-4-5-16)27-21-11-9-19(13-28(14)21)26-23(29)17-6-2-15(3-7-17)18-8-10-20(24)25-12-18/h2-3,6-13,16H,4-5H2,1H3,(H,26,29)
InChIKeyRDMFLPVCZMTDDR-UHFFFAOYSA-N
XLogP4.97
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.43
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide?
The IUPAC name of N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide (CID 23120512) is N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide.
What is the SMILES notation for N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide?
The canonical SMILES for N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide is Cc1c(C2CC2)nc2ccc(NC(=O)c3ccc(-c4ccc(F)nc4)cc3)cn12.
What is the InChIKey of N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide?
The InChIKey is RDMFLPVCZMTDDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN4O/c1-14-22(16-4-5-16)27-21-11-9-19(13-28(14)21)26-23(29)17-6-2-15(3-7-17)18-8-10-20(24)25-12-18/h2-3,6-13,16H,4-5H2,1H3,(H,26,29).
What are the key properties of N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide?
N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide has a molecular weight of 386.43 g/mol, XLogP of 4.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-3-methylimidazo[1,2-a]pyridin-6-yl)-4-(6-fluoro-3-pyridinyl)benzamide is sourced from PubChem (CID 23120512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).