N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide

C19H16ClN5O2 — CID 137300679

IUPACN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide
SMILESO=C(CCc1nc2ccccc2c(=O)[nH]1)NCc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C19H16ClN5O2/c20-12-5-7-17-22-13(11-25(17)10-12)9-21-18(26)8-6-16-23-15-4-2-1-3-14(15)19(27)24-16/h1-5,7,10-11H,6,8-9H2,(H,21,26)(H,23,24,27)
InChIKeyQEOHCIXVDCFYMN-UHFFFAOYSA-N
MW381.82 g/mol
LogP2.47
Rot. Bonds5

About N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide

N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide (PubChem CID 137300679) has the molecular formula C19H16ClN5O2 and a molecular weight of 381.82 g/mol. Its IUPAC name is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide.

Molecular Properties

Compound NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide
PubChem CID137300679
Molecular FormulaC19H16ClN5O2
Molecular Weight381.82 g/mol
Exact Mass381.10
IUPAC NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide
SMILESO=C(CCc1nc2ccccc2c(=O)[nH]1)NCc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C19H16ClN5O2/c20-12-5-7-17-22-13(11-25(17)10-12)9-21-18(26)8-6-16-23-15-4-2-1-3-14(15)19(27)24-16/h1-5,7,10-11H,6,8-9H2,(H,21,26)(H,23,24,27)
InChIKeyQEOHCIXVDCFYMN-UHFFFAOYSA-N
XLogP2.47
TPSA92.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.82
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide with MolForge

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Related Compounds

N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-(4-oxo-3H-quinazolin-2-yl)butanamide
CID 137292591
3-(4-oxo-3H-quinazolin-2-yl)-N-(2-phenylethyl)propanamide
CID 135636453
3-(4-oxo-3H-quinazolin-2-yl)-N-prop-2-ynylpropanamide
CID 135687166
N-[(3-fluorophenyl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide
CID 137292595
3-chloro-N'-[3-(4-oxo-3H-quinazolin-2-yl)propanoyl]benzohydrazide
CID 135915051
N,N-dimethyl-4-[[3-(4-oxo-3H-quinazolin-2-yl)propanoylamino]methyl]benzamide
CID 137300676
N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide
CID 135637123
4-hydroxy-N'-[3-(4-oxo-3H-quinazolin-2-yl)propanoyl]benzohydrazide
CID 135767696
N-benzhydryl-3-(4-oxo-3H-quinazolin-2-yl)propanamide
CID 135724863
N-[(R)-(4-chlorophenyl)-cyclopropylmethyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide
CID 135625093
[2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl] 3-(4-oxo-3H-quinazolin-2-yl)propanoate
CID 135831616
N-[4-[[3-(4-oxo-3H-quinazolin-2-yl)propanoylamino]methyl]phenyl]pyridine-4-carboxamide
CID 167947829

Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide?
The IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide (CID 137300679) is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide.
What is the SMILES notation for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide?
The canonical SMILES for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide is O=C(CCc1nc2ccccc2c(=O)[nH]1)NCc1cn2cc(Cl)ccc2n1.
What is the InChIKey of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide?
The InChIKey is QEOHCIXVDCFYMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN5O2/c20-12-5-7-17-22-13(11-25(17)10-12)9-21-18(26)8-6-16-23-15-4-2-1-3-14(15)19(27)24-16/h1-5,7,10-11H,6,8-9H2,(H,21,26)(H,23,24,27).
What are the key properties of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide?
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide has a molecular weight of 381.82 g/mol, XLogP of 2.47, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide is sourced from PubChem (CID 137300679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).