N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide

C18H15F2N3O3 — CID 27147340

IUPACN-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
SMILESO=C(CCn1cnc2ccccc2c1=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C18H15F2N3O3/c19-18(20)26-15-8-4-3-7-14(15)22-16(24)9-10-23-11-21-13-6-2-1-5-12(13)17(23)25/h1-8,11,18H,9-10H2,(H,22,24)
InChIKeyCJGACGKVUOXTFM-UHFFFAOYSA-N
MW359.33 g/mol
LogP3.03
Rot. Bonds6

About N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide

N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide (PubChem CID 27147340) has the molecular formula C18H15F2N3O3 and a molecular weight of 359.33 g/mol. Its IUPAC name is N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide.

Molecular Properties

Compound NameN-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
PubChem CID27147340
Molecular FormulaC18H15F2N3O3
Molecular Weight359.33 g/mol
Exact Mass359.11
IUPAC NameN-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
SMILESO=C(CCn1cnc2ccccc2c1=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C18H15F2N3O3/c19-18(20)26-15-8-4-3-7-14(15)22-16(24)9-10-23-11-21-13-6-2-1-5-12(13)17(23)25/h1-8,11,18H,9-10H2,(H,22,24)
InChIKeyCJGACGKVUOXTFM-UHFFFAOYSA-N
XLogP3.03
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.33
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(2-chlorophenoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
CID 16573190
N-[2-(4-methylphenoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
CID 27147986
3-(4-oxoquinazolin-3-yl)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 4870595
3-(4-oxoquinazolin-3-yl)-N-(2-phenylsulfanylphenyl)propanamide
CID 52546822
N-[[4-(difluoromethoxy)phenyl]-phenylmethyl]-3-(4-oxoquinazolin-3-yl)propanamide
CID 16573183
N-(4-methyl-2-propoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide
CID 55902104
3-(6-bromo-4-oxoquinazolin-3-yl)-N-(2-methoxyphenyl)propanamide
CID 31301273
N-(3,5-dimethoxyphenyl)-3-(4-oxoquinazolin-3-yl)propanamide
CID 4905328
3-(4-oxoquinazolin-3-yl)-N-(1H-pyrazol-5-yl)propanamide
CID 47083211
3-(4-oxoquinazolin-3-yl)-N-(3,4,5-trimethoxyphenyl)propanamide
CID 26835382
N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide
CID 39724893
N-(2-acetamido-5-methylphenyl)-3-(4-oxoquinazolin-3-yl)propanamide
CID 131906477

Frequently Asked Questions

What is the IUPAC name of N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide?
The IUPAC name of N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide (CID 27147340) is N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide.
What is the SMILES notation for N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide?
The canonical SMILES for N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide is O=C(CCn1cnc2ccccc2c1=O)Nc1ccccc1OC(F)F.
What is the InChIKey of N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide?
The InChIKey is CJGACGKVUOXTFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F2N3O3/c19-18(20)26-15-8-4-3-7-14(15)22-16(24)9-10-23-11-21-13-6-2-1-5-12(13)17(23)25/h1-8,11,18H,9-10H2,(H,22,24).
What are the key properties of N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide?
N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide has a molecular weight of 359.33 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(difluoromethoxy)phenyl]-3-(4-oxoquinazolin-3-yl)propanamide is sourced from PubChem (CID 27147340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).