2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one

C16H17N5O — CID 137264491

IUPAC2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one
SMILESCc1cn2c(n1)CCC(Nc1nc3ccccc3c(=O)[nH]1)C2
InChIInChI=1S/C16H17N5O/c1-10-8-21-9-11(6-7-14(21)17-10)18-16-19-13-5-3-2-4-12(13)15(22)20-16/h2-5,8,11H,6-7,9H2,1H3,(H2,18,19,20,22)
InChIKeyGFOFVUGNJKBQHZ-UHFFFAOYSA-N
MW295.35 g/mol
LogP1.85
Rot. Bonds2

About 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one

2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one (PubChem CID 137264491) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one.

Molecular Properties

Compound Name2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one
PubChem CID137264491
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC Name2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one
SMILESCc1cn2c(n1)CCC(Nc1nc3ccccc3c(=O)[nH]1)C2
InChIInChI=1S/C16H17N5O/c1-10-8-21-9-11(6-7-14(21)17-10)18-16-19-13-5-3-2-4-12(13)15(22)20-16/h2-5,8,11H,6-7,9H2,1H3,(H2,18,19,20,22)
InChIKeyGFOFVUGNJKBQHZ-UHFFFAOYSA-N
XLogP1.85
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one with MolForge

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Related Compounds

2-[(1-propanoylpyrrolidin-3-yl)amino]-3H-quinazolin-4-one
CID 137270751
2-[[1-(2-methylsulfonylethyl)piperidin-4-yl]amino]-3H-quinazolin-4-one
CID 137268392
2-[[1-(1-methylpyrazol-4-yl)-2-oxopyrrolidin-3-yl]amino]-3H-quinazolin-4-one
CID 137271144
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2,4-dioxo-1H-quinazoline-6-sulfonamide
CID 71926432
trans-(1R,3R)-3-[(4-oxo-3H-quinazolin-2-yl)amino]-N-propan-2-ylcyclohexane-1-carboxamide
CID 136803515
trans-(1S,3S)-3-[(4-oxo-3H-quinazolin-2-yl)amino]-N-propan-2-ylcyclohexane-1-carboxamide
CID 136803514
(2S)-2-methoxy-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-phenylacetamide
CID 95765920
2-[[(4S)-8-methyl-3,4-dihydro-2H-chromen-4-yl]amino]-3H-quinazolin-4-one
CID 136581117
N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(5-phenyl-1H-pyrrol-2-yl)propanamide
CID 95138623
(2S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95765302
(2S)-1-benzyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]pyrrolidine-2-carboxamide
CID 95766087
(3S)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2,3-dihydro-1-benzothiophene-3-carboxamide
CID 95771455

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one?
The IUPAC name of 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one (CID 137264491) is 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one.
What is the SMILES notation for 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one?
The canonical SMILES for 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one is Cc1cn2c(n1)CCC(Nc1nc3ccccc3c(=O)[nH]1)C2.
What is the InChIKey of 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one?
The InChIKey is GFOFVUGNJKBQHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c1-10-8-21-9-11(6-7-14(21)17-10)18-16-19-13-5-3-2-4-12(13)15(22)20-16/h2-5,8,11H,6-7,9H2,1H3,(H2,18,19,20,22).
What are the key properties of 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one?
2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one has a molecular weight of 295.35 g/mol, XLogP of 1.85, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one is sourced from PubChem (CID 137264491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).