7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide

C17H17ClN6O2 — CID 155914388

IUPAC7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide
SMILESCc1nc2ccc(Cl)cn2c1C(=O)N1CCc2nc(C(N)=O)cn2CC1
InChIInChI=1S/C17H17ClN6O2/c1-10-15(24-8-11(18)2-3-14(24)20-10)17(26)22-5-4-13-21-12(16(19)25)9-23(13)7-6-22/h2-3,8-9H,4-7H2,1H3,(H2,19,25)
InChIKeySKOSCLDTSQMNAR-UHFFFAOYSA-N
MW372.82 g/mol
LogP1.29
Rot. Bonds2

About 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide

7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide (PubChem CID 155914388) has the molecular formula C17H17ClN6O2 and a molecular weight of 372.82 g/mol. Its IUPAC name is 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide.

Molecular Properties

Compound Name7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide
PubChem CID155914388
Molecular FormulaC17H17ClN6O2
Molecular Weight372.82 g/mol
Exact Mass372.11
IUPAC Name7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide
SMILESCc1nc2ccc(Cl)cn2c1C(=O)N1CCc2nc(C(N)=O)cn2CC1
InChIInChI=1S/C17H17ClN6O2/c1-10-15(24-8-11(18)2-3-14(24)20-10)17(26)22-5-4-13-21-12(16(19)25)9-23(13)7-6-22/h2-3,8-9H,4-7H2,1H3,(H2,19,25)
InChIKeySKOSCLDTSQMNAR-UHFFFAOYSA-N
XLogP1.29
TPSA98.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.82
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide with MolForge

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Related Compounds

(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[4-(2-fluorophenoxy)piperidin-1-yl]methanone
CID 46969368
3-[4-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)piperazin-1-yl]-1H-pyrazin-2-one
CID 119069229
(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepan-1-yl]methanone
CID 46957604
7-(2-pyrimidin-2-yl-1,3-thiazole-4-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide
CID 155918534
7-(4-methoxy-1H-indole-2-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide
CID 155909473
7-[2-(4-chloropyrazol-1-yl)propanoyl]-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide;formic acid
CID 155972269
(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(2R)-2-phenylpyrrolidin-1-yl]methanone
CID 124953289
(6-chloro-3-fluoroimidazo[1,2-a]pyridin-2-yl)-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)methanone
CID 157018467
(2,6-dimethylimidazo[1,2-a]pyridin-3-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
CID 110660029
4-[(3S)-1-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)piperidin-3-yl]-1H-pyrimidin-6-one
CID 136883288
(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3R,4R)-3-hydroxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-1-yl]methanone
CID 135118591
2-tert-butyl-6-chloroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 80503406

Frequently Asked Questions

What is the IUPAC name of 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide?
The IUPAC name of 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide (CID 155914388) is 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide.
What is the SMILES notation for 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide?
The canonical SMILES for 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide is Cc1nc2ccc(Cl)cn2c1C(=O)N1CCc2nc(C(N)=O)cn2CC1.
What is the InChIKey of 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide?
The InChIKey is SKOSCLDTSQMNAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN6O2/c1-10-15(24-8-11(18)2-3-14(24)20-10)17(26)22-5-4-13-21-12(16(19)25)9-23(13)7-6-22/h2-3,8-9H,4-7H2,1H3,(H2,19,25).
What are the key properties of 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide?
7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide has a molecular weight of 372.82 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(6-chloro-2-methylimidazo[1,2-a]pyridine-3-carbonyl)-5,6,8,9-tetrahydroimidazo[1,2-d][1,4]diazepine-2-carboxamide is sourced from PubChem (CID 155914388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).