N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide

C20H17FN2O3 — CID 131889577

IUPACN-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide
SMILESCc1cc(NC(=O)c2c(C)cccc2F)ccc1NC(=O)c1ccco1
InChIInChI=1S/C20H17FN2O3/c1-12-5-3-6-15(21)18(12)20(25)22-14-8-9-16(13(2)11-14)23-19(24)17-7-4-10-26-17/h3-11H,1-2H3,(H,22,25)(H,23,24)
InChIKeyNRRPEYFZHJDTAF-UHFFFAOYSA-N
MW352.37 g/mol
LogP4.54
Rot. Bonds4

About N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide

N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide (PubChem CID 131889577) has the molecular formula C20H17FN2O3 and a molecular weight of 352.37 g/mol. Its IUPAC name is N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide
PubChem CID131889577
Molecular FormulaC20H17FN2O3
Molecular Weight352.37 g/mol
Exact Mass352.12
IUPAC NameN-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide
SMILESCc1cc(NC(=O)c2c(C)cccc2F)ccc1NC(=O)c1ccco1
InChIInChI=1S/C20H17FN2O3/c1-12-5-3-6-15(21)18(12)20(25)22-14-8-9-16(13(2)11-14)23-19(24)17-7-4-10-26-17/h3-11H,1-2H3,(H,22,25)(H,23,24)
InChIKeyNRRPEYFZHJDTAF-UHFFFAOYSA-N
XLogP4.54
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.37
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-methyl-4-(methylamino)phenyl]furan-2-carboxamide
CID 91677831
N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 1141339
N-[4-[(4-fluoro-2-methylphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 9426257
N-(3,4-dimethylphenyl)furan-2-carboxamide
CID 689600
N-[2-methyl-4-[(3-methylthiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide
CID 122132677
N-[4-(3-chloropropanoylamino)-2-methylphenyl]furan-2-carboxamide
CID 4221258
N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide
CID 650804
N-[4-(4-aminobutanoylamino)-2-methylphenyl]furan-2-carboxamide;hydrochloride
CID 119300225
N-(4-iodo-2-methylphenyl)furan-2-carboxamide
CID 723686
N-[2-methyl-4-[(4-propan-2-yloxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 1086037
N-[4-(3-aminobutanoylamino)-2-methylphenyl]furan-2-carboxamide
CID 119743182
5-(3,4-dimethylphenyl)-N-[4-(furan-2-carbonylamino)-3-methylphenyl]furan-2-carboxamide
CID 4287180

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide (CID 131889577) is N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide is Cc1cc(NC(=O)c2c(C)cccc2F)ccc1NC(=O)c1ccco1.
What is the InChIKey of N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide?
The InChIKey is NRRPEYFZHJDTAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O3/c1-12-5-3-6-15(21)18(12)20(25)22-14-8-9-16(13(2)11-14)23-19(24)17-7-4-10-26-17/h3-11H,1-2H3,(H,22,25)(H,23,24).
What are the key properties of N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide?
N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide has a molecular weight of 352.37 g/mol, XLogP of 4.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide is sourced from PubChem (CID 131889577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).