2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one

C22H22N4O2 — CID 170391559

IUPAC2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one
SMILESCC(C)(C)c1ccc2nc(CCC(=O)c3cc(=O)n4ccccc4n3)cn2c1
InChIInChI=1S/C22H22N4O2/c1-22(2,3)15-7-10-19-23-16(14-25(19)13-15)8-9-18(27)17-12-21(28)26-11-5-4-6-20(26)24-17/h4-7,10-14H,8-9H2,1-3H3
InChIKeyNFVGAADAKYGAKZ-UHFFFAOYSA-N
MW374.44 g/mol
LogP3.46
Rot. Bonds4

About 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one

2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one (PubChem CID 170391559) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one
PubChem CID170391559
Molecular FormulaC22H22N4O2
Molecular Weight374.44 g/mol
Exact Mass374.17
IUPAC Name2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one
SMILESCC(C)(C)c1ccc2nc(CCC(=O)c3cc(=O)n4ccccc4n3)cn2c1
InChIInChI=1S/C22H22N4O2/c1-22(2,3)15-7-10-19-23-16(14-25(19)13-15)8-9-18(27)17-12-21(28)26-11-5-4-6-20(26)24-17/h4-7,10-14H,8-9H2,1-3H3
InChIKeyNFVGAADAKYGAKZ-UHFFFAOYSA-N
XLogP3.46
TPSA68.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one with MolForge

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Related Compounds

N-[(6-cyanoimidazo[1,2-a]pyridin-2-yl)methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
CID 155167590
N-[[6-[(4-tert-butylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
CID 155167642
4-oxo-N-[[6-[(3,3,3-trifluoropropylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]pyrido[1,2-a]pyrimidine-2-carboxamide
CID 155167703
N-[[6-(2-anilino-2-oxoethyl)imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
CID 162715461
N-[[6-[[(2,2-dimethylcyclopropyl)methylamino]methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
CID 155167361
N-[[6-[[(2-fluorophenyl)methylamino]methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
CID 155167659
(4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 7-methylimidazo[1,2-a]pyridine-2-carboxylate
CID 42897218
4-oxo-N-[[6-[(1,3-thiazol-5-ylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]pyrido[1,2-a]pyrimidine-2-carboxamide
CID 155167347
N-tert-butyl-2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylamino]acetamide
CID 78915598
2-[(2,2-dimethylpropylamino)methyl]pyrido[1,2-a]pyrimidin-4-one
CID 55104756
N-[[6-[[[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]-methylamino]methyl]imidazo[1,2-a]pyridin-2-yl]methyl]-4-oxopyrido[1,2-a]pyrimidine-2-carboxamide
CID 155167408
2-[(4-methylanilino)methyl]pyrido[1,2-a]pyrimidin-4-one
CID 60671462

Frequently Asked Questions

What is the IUPAC name of 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one (CID 170391559) is 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one is CC(C)(C)c1ccc2nc(CCC(=O)c3cc(=O)n4ccccc4n3)cn2c1.
What is the InChIKey of 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is NFVGAADAKYGAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c1-22(2,3)15-7-10-19-23-16(14-25(19)13-15)8-9-18(27)17-12-21(28)26-11-5-4-6-20(26)24-17/h4-7,10-14H,8-9H2,1-3H3.
What are the key properties of 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one?
2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 374.44 g/mol, XLogP of 3.46, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(6-tert-butylimidazo[1,2-a]pyridin-2-yl)propanoyl]pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 170391559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).