2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide

C24H27N7O — CID 44526237

IUPAC2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide
SMILESCn1ccnc1-c1nc2ccccn2c1NCC(=O)Nc1ccccc1N1CCCCC1
InChIInChI=1S/C24H27N7O/c1-29-16-12-25-23(29)22-24(31-15-8-5-11-20(31)28-22)26-17-21(32)27-18-9-3-4-10-19(18)30-13-6-2-7-14-30/h3-5,8-12,15-16,26H,2,6-7,13-14,17H2,1H3,(H,27,32)
InChIKeyVTATWPVQRJRCQP-UHFFFAOYSA-N
MW429.53 g/mol
LogP3.78
Rot. Bonds6

About 2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide

2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide (PubChem CID 44526237) has the molecular formula C24H27N7O and a molecular weight of 429.53 g/mol. Its IUPAC name is 2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide
PubChem CID44526237
Molecular FormulaC24H27N7O
Molecular Weight429.53 g/mol
Exact Mass429.23
IUPAC Name2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide
SMILESCn1ccnc1-c1nc2ccccn2c1NCC(=O)Nc1ccccc1N1CCCCC1
InChIInChI=1S/C24H27N7O/c1-29-16-12-25-23(29)22-24(31-15-8-5-11-20(31)28-22)26-17-21(32)27-18-9-3-4-10-19(18)30-13-6-2-7-14-30/h3-5,8-12,15-16,26H,2,6-7,13-14,17H2,1H3,(H,27,32)
InChIKeyVTATWPVQRJRCQP-UHFFFAOYSA-N
XLogP3.78
TPSA79.49 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.53
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide?
The IUPAC name of 2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide (CID 44526237) is 2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide is Cn1ccnc1-c1nc2ccccn2c1NCC(=O)Nc1ccccc1N1CCCCC1.
What is the InChIKey of 2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide?
The InChIKey is VTATWPVQRJRCQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N7O/c1-29-16-12-25-23(29)22-24(31-15-8-5-11-20(31)28-22)26-17-21(32)27-18-9-3-4-10-19(18)30-13-6-2-7-14-30/h3-5,8-12,15-16,26H,2,6-7,13-14,17H2,1H3,(H,27,32).
What are the key properties of 2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide?
2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide has a molecular weight of 429.53 g/mol, XLogP of 3.78, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(1-methylimidazol-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-N-(2-piperidin-1-ylphenyl)acetamide is sourced from PubChem (CID 44526237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).