6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide

C28H26ClN7O2 — CID 171678357

IUPAC6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nc2ccc(Cl)cn2c1C(=O)Nc1ccc(C2CCN(C(=O)c3ccc4nncn4c3)CC2)cc1
InChIInChI=1S/C28H26ClN7O2/c1-2-23-26(36-16-21(29)6-10-24(36)32-23)27(37)31-22-7-3-18(4-8-22)19-11-13-34(14-12-19)28(38)20-5-9-25-33-30-17-35(25)15-20/h3-10,15-17,19H,2,11-14H2,1H3,(H,31,37)
InChIKeyQATZPBFICGRXAO-UHFFFAOYSA-N
MW528.02 g/mol
LogP4.86
Rot. Bonds5

About 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide

6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 171678357) has the molecular formula C28H26ClN7O2 and a molecular weight of 528.02 g/mol. Its IUPAC name is 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID171678357
Molecular FormulaC28H26ClN7O2
Molecular Weight528.02 g/mol
Exact Mass527.18
IUPAC Name6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nc2ccc(Cl)cn2c1C(=O)Nc1ccc(C2CCN(C(=O)c3ccc4nncn4c3)CC2)cc1
InChIInChI=1S/C28H26ClN7O2/c1-2-23-26(36-16-21(29)6-10-24(36)32-23)27(37)31-22-7-3-18(4-8-22)19-11-13-34(14-12-19)28(38)20-5-9-25-33-30-17-35(25)15-20/h3-10,15-17,19H,2,11-14H2,1H3,(H,31,37)
InChIKeyQATZPBFICGRXAO-UHFFFAOYSA-N
XLogP4.86
TPSA96.90 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500528.02
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide with MolForge

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Related Compounds

6-chloro-2-ethyl-N-[[4-[1-(4-fluorobenzoyl)piperidin-4-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71009880
N-[4-[1-(6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyrimidine-2-carboxamide
CID 171678131
8-chloro-N-[4-[1-(4-chloro-3-ethyl-1-methylpyrazole-5-carbonyl)piperidin-4-yl]phenyl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 171681034
6-chloro-2-ethyl-N-[[4-(4-pyridin-4-ylpiperidin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 135194026
6-chloro-N-[2-methyl-5-[4-([1,2,4]triazolo[4,3-a]pyridin-6-yl)piperidine-1-carbonyl]phenyl]pyridine-3-carboxamide
CID 118144180
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethyl)phenyl]piperidin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 121442269
6-chloro-2-ethyl-N-[[4-(1-pyridin-3-ylpiperidin-4-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 135194050
(6-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-[4-[(4-chlorophenyl)methoxy]piperidin-1-yl]methanone
CID 71009985
piperidin-1-yl([1,2,4]triazolo[4,3-a]pyridin-6-yl)methanone
CID 97211491
N-[[4-[1-(4-tert-butylphenyl)piperidin-4-yl]-2-fluorophenyl]methyl]-6-chloro-2-ethylimidazo[1,2-a]pyridine-3-carboxamide;hydrochloride
CID 163202318
6-chloro-2-ethyl-N-[[4-(4-pyridin-2-ylpiperidin-1-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 135193991
6-chloro-2-ethyl-N-[[4-(2-methyl-2-azaspiro[3.3]heptan-6-yl)phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 163564312

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 171678357) is 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide is CCc1nc2ccc(Cl)cn2c1C(=O)Nc1ccc(C2CCN(C(=O)c3ccc4nncn4c3)CC2)cc1.
What is the InChIKey of 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is QATZPBFICGRXAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26ClN7O2/c1-2-23-26(36-16-21(29)6-10-24(36)32-23)27(37)31-22-7-3-18(4-8-22)19-11-13-34(14-12-19)28(38)20-5-9-25-33-30-17-35(25)15-20/h3-10,15-17,19H,2,11-14H2,1H3,(H,31,37).
What are the key properties of 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide?
6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 528.02 g/mol, XLogP of 4.86, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-ethyl-N-[4-[1-([1,2,4]triazolo[4,3-a]pyridine-6-carbonyl)piperidin-4-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 171678357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).