N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide

C17H15FN4O2 — CID 90342899

IUPACN-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide
SMILESCOc1ccc(-n2c(C(=O)NC3CC3)nc3cccnc32)cc1F
InChIInChI=1S/C17H15FN4O2/c1-24-14-7-6-11(9-12(14)18)22-15-13(3-2-8-19-15)21-16(22)17(23)20-10-4-5-10/h2-3,6-10H,4-5H2,1H3,(H,20,23)
InChIKeyCTIFTNSATDMQFB-UHFFFAOYSA-N
MW326.33 g/mol
LogP2.46
Rot. Bonds4

About N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide

N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide (PubChem CID 90342899) has the molecular formula C17H15FN4O2 and a molecular weight of 326.33 g/mol. Its IUPAC name is N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide
PubChem CID90342899
Molecular FormulaC17H15FN4O2
Molecular Weight326.33 g/mol
Exact Mass326.12
IUPAC NameN-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide
SMILESCOc1ccc(-n2c(C(=O)NC3CC3)nc3cccnc32)cc1F
InChIInChI=1S/C17H15FN4O2/c1-24-14-7-6-11(9-12(14)18)22-15-13(3-2-8-19-15)21-16(22)17(23)20-10-4-5-10/h2-3,6-10H,4-5H2,1H3,(H,20,23)
InChIKeyCTIFTNSATDMQFB-UHFFFAOYSA-N
XLogP2.46
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.33
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,6-Difluorophenoxy)-N-(2-fluorophenyl)-9-isopropyl-9H-purin-8-amine
CID 9543517
9-cyclopentyl-N(8)-(2-fluorophenyl)-N(2)-(4-methoxyphenyl)-9H-purine-2,8-diamine
CID 11647397
trans-N-[3-(4-methoxy-phenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl]-cyclohexane-1,4-diamine
CID 90389602
N-[4-[1-methyl-2-[3-(trifluoromethoxy)anilino]benzimidazol-5-yl]oxypyridin-2-yl]acetamide
CID 57568471
N-[4-[1-methyl-2-[4-(trifluoromethoxy)anilino]benzimidazol-5-yl]oxypyridin-2-yl]acetamide
CID 57568562
N-(4-methoxyphenyl)-1-methyl-1H-imidazo[4,5-c]pyridin-4-amine
CID 15266433
3-{3-Benzyl-3H-imidazo[4,5-B]pyridin-2-YL}-N-[(4-methoxyphenyl)methyl]propanamide
CID 16009052
(2S)-2-(((3-Cyclobutyl-5-(3,4,5-trifluorophenoxy)-3H-imidazo(4,5-b)pyridin-2-yl)methyl)amino)propanamide
CID 129080919
5H-Pyrrolo(3,2-d)pyrimidine-2,4-diamine, N,N'-bis(4-methoxyphenyl)-
CID 5748926
N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 11675867
4-(1-isopropyl-2-methyl-1H-imidazol-5-yl)-N-(4-methoxyphenyl)pyrimidin-2-amine
CID 44578538
9-(4-Methoxyphenyl)-9h-purine-2,6-diamine
CID 240288

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide?
The IUPAC name of N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide (CID 90342899) is N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide is COc1ccc(-n2c(C(=O)NC3CC3)nc3cccnc32)cc1F.
What is the InChIKey of N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide?
The InChIKey is CTIFTNSATDMQFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN4O2/c1-24-14-7-6-11(9-12(14)18)22-15-13(3-2-8-19-15)21-16(22)17(23)20-10-4-5-10/h2-3,6-10H,4-5H2,1H3,(H,20,23).
What are the key properties of N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide?
N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide has a molecular weight of 326.33 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(3-fluoro-4-methoxyphenyl)imidazo[4,5-b]pyridine-2-carboxamide is sourced from PubChem (CID 90342899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).