N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide

C15H13N3O3 — CID 135941989

IUPACN-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide
SMILESCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccoc1
InChIInChI=1S/C15H13N3O3/c1-18(15(20)10-6-7-21-9-10)8-13-16-12-5-3-2-4-11(12)14(19)17-13/h2-7,9H,8H2,1H3,(H,16,17,19)
InChIKeySOCQGSRFUCFNPT-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.79
Rot. Bonds3

About N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide

N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide (PubChem CID 135941989) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide
PubChem CID135941989
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC NameN-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide
SMILESCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccoc1
InChIInChI=1S/C15H13N3O3/c1-18(15(20)10-6-7-21-9-10)8-13-16-12-5-3-2-4-11(12)14(19)17-13/h2-7,9H,8H2,1H3,(H,16,17,19)
InChIKeySOCQGSRFUCFNPT-UHFFFAOYSA-N
XLogP1.79
TPSA79.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-oxo-3H-quinazolin-2-yl)methyl]-N-propan-2-ylfuran-3-carboxamide
CID 137316111
N,3-dimethyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-2-carboxamide
CID 135570319
3-chloro-N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]benzamide
CID 135570413
N-methyl-2-methylsulfanyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]acetamide
CID 135951735
N-methyl-4-oxo-N-[(4-oxo-3H-quinazolin-2-yl)methyl]pyrido[1,2-a]pyrimidine-3-carboxamide
CID 135686740
1-methyl-3-(2-methylpropyl)-1-[(4-oxo-3H-quinazolin-2-yl)methyl]urea
CID 135687276
N-methyl-2-naphthalen-1-yl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]acetamide
CID 135690319
N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-2-phenyl-1,3-thiazole-4-carboxamide
CID 135899747
N,2,5-trimethyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]-1-propan-2-ylpyrrole-3-carboxamide
CID 135877066
1-methyl-1-[(4-oxo-3H-quinazolin-2-yl)methyl]-3-(2-phenylethyl)thiourea
CID 135570435
4-methyl-N-[2-[methyl-[(4-oxo-3H-quinazolin-2-yl)methyl]amino]-2-oxoethyl]benzamide
CID 135903821
5-acetamido-N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]thiophene-2-carboxamide
CID 135886880

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide?
The IUPAC name of N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide (CID 135941989) is N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide.
What is the SMILES notation for N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide?
The canonical SMILES for N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide is CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccoc1.
What is the InChIKey of N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide?
The InChIKey is SOCQGSRFUCFNPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c1-18(15(20)10-6-7-21-9-10)8-13-16-12-5-3-2-4-11(12)14(19)17-13/h2-7,9H,8H2,1H3,(H,16,17,19).
What are the key properties of N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide?
N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide has a molecular weight of 283.29 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(4-oxo-3H-quinazolin-2-yl)methyl]furan-3-carboxamide is sourced from PubChem (CID 135941989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).