N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide

C17H25N3O3 — CID 69489766

IUPACN-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide
SMILESCCC(C)NC(=O)c1cn2c(C)c(C)nc2c(O)c1C(O)CC
InChIInChI=1S/C17H25N3O3/c1-6-9(3)18-17(23)12-8-20-11(5)10(4)19-16(20)15(22)14(12)13(21)7-2/h8-9,13,21-22H,6-7H2,1-5H3,(H,18,23)
InChIKeyYLLHRGPVRIRGLN-UHFFFAOYSA-N
MW319.41 g/mol
LogP2.63
Rot. Bonds5

About N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide

N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 69489766) has the molecular formula C17H25N3O3 and a molecular weight of 319.41 g/mol. Its IUPAC name is N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide
PubChem CID69489766
Molecular FormulaC17H25N3O3
Molecular Weight319.41 g/mol
Exact Mass319.19
IUPAC NameN-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide
SMILESCCC(C)NC(=O)c1cn2c(C)c(C)nc2c(O)c1C(O)CC
InChIInChI=1S/C17H25N3O3/c1-6-9(3)18-17(23)12-8-20-11(5)10(4)19-16(20)15(22)14(12)13(21)7-2/h8-9,13,21-22H,6-7H2,1-5H3,(H,18,23)
InChIKeyYLLHRGPVRIRGLN-UHFFFAOYSA-N
XLogP2.63
TPSA86.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 52.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-butan-2-yl-2-hydroxy-3-methylbenzamide
CID 43176510
N-[(2R)-butan-2-yl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1097804
1-ethyl-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)pyrazole-4-carboxamide
CID 4772972
N-butan-2-yl-2-methyl-1,6-naphthyridine-3-carboxamide
CID 110848504
N-butan-2-yl-1-tert-butyl-6-[(4-methylbenzoyl)amino]pyrrolo[2,3-b]pyridine-3-carboxamide
CID 68805971
N-[(2S)-butan-2-yl]-7-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 34674868
N-butan-2-yl-2,5-dimethyl-1-(2-pyrrolidin-1-ylethyl)pyrrole-3-carboxamide
CID 53149865
N-butan-2-yl-2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 60714205
3-[(5-methyl-1-pentan-3-ylpyrazole-4-carbonyl)amino]butanoic acid
CID 120522803
N-butan-2-yl-2,5-dimethyl-1H-pyrrole-3-carboxamide
CID 110766106
N-[(2S)-butan-2-yl]-2,5-dimethylbenzamide
CID 925430
N-[(2S)-butan-2-yl]-2-methylfuran-3-carboxamide
CID 40584922

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide (CID 69489766) is N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide is CCC(C)NC(=O)c1cn2c(C)c(C)nc2c(O)c1C(O)CC.
What is the InChIKey of N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is YLLHRGPVRIRGLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-6-9(3)18-17(23)12-8-20-11(5)10(4)19-16(20)15(22)14(12)13(21)7-2/h8-9,13,21-22H,6-7H2,1-5H3,(H,18,23).
What are the key properties of N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide?
N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 319.41 g/mol, XLogP of 2.63, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-8-hydroxy-7-(1-hydroxypropyl)-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 69489766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).