N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide

C22H26N4O2 — CID 165012438

IUPACN-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2cn3cc(CCC(C)(C)O)nc3cc2C2CC2)n1
InChIInChI=1S/C22H26N4O2/c1-14-5-4-6-18(23-14)21(27)25-19-13-26-12-16(9-10-22(2,3)28)24-20(26)11-17(19)15-7-8-15/h4-6,11-13,15,28H,7-10H2,1-3H3,(H,25,27)
InChIKeyUNNQDJKPYPQYKE-UHFFFAOYSA-N
MW378.48 g/mol
LogP3.87
Rot. Bonds6

About N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide

N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide (PubChem CID 165012438) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
PubChem CID165012438
Molecular FormulaC22H26N4O2
Molecular Weight378.48 g/mol
Exact Mass378.21
IUPAC NameN-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2cn3cc(CCC(C)(C)O)nc3cc2C2CC2)n1
InChIInChI=1S/C22H26N4O2/c1-14-5-4-6-18(23-14)21(27)25-19-13-26-12-16(9-10-22(2,3)28)24-20(26)11-17(19)15-7-8-15/h4-6,11-13,15,28H,7-10H2,1-3H3,(H,25,27)
InChIKeyUNNQDJKPYPQYKE-UHFFFAOYSA-N
XLogP3.87
TPSA79.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(3-hydroxy-3-methylbutyl)-7-methoxyimidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
CID 155166969
N-[7-(4-acetylpiperazin-1-yl)-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
CID 164991898
N-(cyclopropylmethyl)-2-(3-hydroxy-3-methylbutyl)-6-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]imidazo[1,2-a]pyridine-7-carboxamide
CID 155167173
N-[7-cyano-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;2-(3-hydroxy-3-methylbutyl)-6-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]imidazo[1,2-a]pyridine-7-carboxamide
CID 165028576
N-[2-(3,3-difluorocyclobutyl)-7-ethoxyimidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
CID 164996643
N-[7-(4,4-dimethylpiperidin-1-yl)-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-2-(2-methyl-4-pyridinyl)-1,3-oxazole-4-carboxamide
CID 155483924
2-(2-acetamido-4-pyridinyl)-N-[2-(3-hydroxy-3-methylbutyl)-7-piperidin-1-ylimidazo[1,2-a]pyridin-6-yl]-1,3-oxazole-4-carboxamide
CID 170361497
N-[2-[4-(hydroxymethyl)cyclohexyl]-5-(2-hydroxypropan-2-yl)-1,3-benzoxazol-6-yl]-6-methylpyridine-2-carboxamide
CID 170238978
ethyl 3-[7-bromo-6-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]imidazo[1,2-a]pyridin-2-yl]propanoate
CID 155167092
2-(3-hydroxy-3-methylbutyl)-3-methyl-5-[(6-methylpyridine-2-carbonyl)amino]indazole-6-carboxylic acid
CID 121364949
3-[7-(4-carbamoylpiperidin-1-yl)-6-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]imidazo[1,2-a]pyridin-2-yl]propanoic acid
CID 164822108
6-acetamido-N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)pyridine-2-carboxamide
CID 154655727

Frequently Asked Questions

What is the IUPAC name of N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide?
The IUPAC name of N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide (CID 165012438) is N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)Nc2cn3cc(CCC(C)(C)O)nc3cc2C2CC2)n1.
What is the InChIKey of N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide?
The InChIKey is UNNQDJKPYPQYKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2/c1-14-5-4-6-18(23-14)21(27)25-19-13-26-12-16(9-10-22(2,3)28)24-20(26)11-17(19)15-7-8-15/h4-6,11-13,15,28H,7-10H2,1-3H3,(H,25,27).
What are the key properties of N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide?
N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide has a molecular weight of 378.48 g/mol, XLogP of 3.87, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-cyclopropyl-2-(3-hydroxy-3-methylbutyl)imidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 165012438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).