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

C17H19N5O — CID 137264176

IUPAC2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one
SMILESO=c1[nH]c(NCCc2cn3c(n2)CCCC3)nc2ccccc12
InChIInChI=1S/C17H19N5O/c23-16-13-5-1-2-6-14(13)20-17(21-16)18-9-8-12-11-22-10-4-3-7-15(22)19-12/h1-2,5-6,11H,3-4,7-10H2,(H2,18,20,21,23)
InChIKeyAIZLUSQDBDPBLU-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.11
Rot. Bonds4

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

2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one (PubChem CID 137264176) has the molecular formula C17H19N5O and a molecular weight of 309.37 g/mol. Its IUPAC name is 2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one.

Molecular Properties

Compound Name2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one
PubChem CID137264176
Molecular FormulaC17H19N5O
Molecular Weight309.37 g/mol
Exact Mass309.16
IUPAC Name2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one
SMILESO=c1[nH]c(NCCc2cn3c(n2)CCCC3)nc2ccccc12
InChIInChI=1S/C17H19N5O/c23-16-13-5-1-2-6-14(13)20-17(21-16)18-9-8-12-11-22-10-4-3-7-15(22)19-12/h1-2,5-6,11H,3-4,7-10H2,(H2,18,20,21,23)
InChIKeyAIZLUSQDBDPBLU-UHFFFAOYSA-N
XLogP2.11
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

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Related Compounds

2-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]-3H-quinazolin-4-one
CID 137264057
2-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one
CID 136779605
N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]benzamide
CID 42950879
2-ethylsulfonyl-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]aniline
CID 99790091
2-(propylamino)-3H-quinazolin-4-one
CID 135439661
2-[[2-(azepan-1-ylmethyl)phenyl]methylamino]-3H-quinazolin-4-one
CID 137251073
3-methylsulfonyl-2-nitro-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]aniline
CID 133393359
1-[6-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3-pyridinyl]ethanone
CID 91650965
2-[(3-hydroxy-3-phenylbutyl)amino]-3H-quinazolin-4-one
CID 137267444
2-[3-(2-hydroxycyclohexyl)propylamino]-3H-quinazolin-4-one
CID 137265029
2-(5-methoxypentylamino)-3H-quinazolin-4-one
CID 137264454
2-[(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)amino]-3H-quinazolin-4-one
CID 137264491

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one?
The IUPAC name of 2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one (CID 137264176) is 2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one.
What is the SMILES notation for 2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one?
The canonical SMILES for 2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one is O=c1[nH]c(NCCc2cn3c(n2)CCCC3)nc2ccccc12.
What is the InChIKey of 2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one?
The InChIKey is AIZLUSQDBDPBLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O/c23-16-13-5-1-2-6-14(13)20-17(21-16)18-9-8-12-11-22-10-4-3-7-15(22)19-12/h1-2,5-6,11H,3-4,7-10H2,(H2,18,20,21,23).
What are the key properties of 2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one?
2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one has a molecular weight of 309.37 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethylamino]-3H-quinazolin-4-one is sourced from PubChem (CID 137264176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).