N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide

C15H21N3O2 — CID 175305720

IUPACN-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1ccn2cc(C(=O)NC(CO)C(C)(C)C)nc2c1
InChIInChI=1S/C15H21N3O2/c1-10-5-6-18-8-11(16-13(18)7-10)14(20)17-12(9-19)15(2,3)4/h5-8,12,19H,9H2,1-4H3,(H,17,20)
InChIKeyPDKPSDRCFBVVJL-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.78
Rot. Bonds3

About N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide

N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 175305720) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID175305720
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1ccn2cc(C(=O)NC(CO)C(C)(C)C)nc2c1
InChIInChI=1S/C15H21N3O2/c1-10-5-6-18-8-11(16-13(18)7-10)14(20)17-12(9-19)15(2,3)4/h5-8,12,19H,9H2,1-4H3,(H,17,20)
InChIKeyPDKPSDRCFBVVJL-UHFFFAOYSA-N
XLogP1.78
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide (CID 175305720) is N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide is Cc1ccn2cc(C(=O)NC(CO)C(C)(C)C)nc2c1.
What is the InChIKey of N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is PDKPSDRCFBVVJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-10-5-6-18-8-11(16-13(18)7-10)14(20)17-12(9-19)15(2,3)4/h5-8,12,19H,9H2,1-4H3,(H,17,20).
What are the key properties of N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide?
N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-3,3-dimethylbutan-2-yl)-7-methylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 175305720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).