N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide

C18H15N3O3 — CID 650804

IUPACN-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cccnc2)ccc1NC(=O)c1ccco1
InChIInChI=1S/C18H15N3O3/c1-12-10-14(20-17(22)13-4-2-8-19-11-13)6-7-15(12)21-18(23)16-5-3-9-24-16/h2-11H,1H3,(H,20,22)(H,21,23)
InChIKeyRHKCPTJIDSINEA-UHFFFAOYSA-N
MW321.34 g/mol
LogP3.49
Rot. Bonds4

About N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide

N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide (PubChem CID 650804) has the molecular formula C18H15N3O3 and a molecular weight of 321.34 g/mol. Its IUPAC name is N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide
PubChem CID650804
Molecular FormulaC18H15N3O3
Molecular Weight321.34 g/mol
Exact Mass321.11
IUPAC NameN-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cccnc2)ccc1NC(=O)c1ccco1
InChIInChI=1S/C18H15N3O3/c1-12-10-14(20-17(22)13-4-2-8-19-11-13)6-7-15(12)21-18(23)16-5-3-9-24-16/h2-11H,1H3,(H,20,22)(H,21,23)
InChIKeyRHKCPTJIDSINEA-UHFFFAOYSA-N
XLogP3.49
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-methyl-4-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide
CID 1141339
N-[4-(furan-2-carbonylamino)-3-methylphenyl]-2,1,3-benzothiadiazole-5-carboxamide
CID 17274588
N-[2-methyl-4-(methylamino)phenyl]furan-2-carboxamide
CID 91677831
N-[2-methyl-4-[(4-propan-2-yloxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 1086037
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-(3-benzamido-4-methylphenyl)pyridine-3-carboxamide
CID 6486649
N-[4-[(2-fluoro-6-methylbenzoyl)amino]-2-methylphenyl]furan-2-carboxamide
CID 131889577
5-(3,4-dimethylphenyl)-N-[4-(furan-2-carbonylamino)-3-methylphenyl]furan-2-carboxamide
CID 4287180
5-(dimethylsulfamoyl)-N-[4-(furan-2-carbonylamino)-3-methylphenyl]furan-2-carboxamide
CID 154858775
N-[4-(3-chloropropanoylamino)-2-methylphenyl]furan-2-carboxamide
CID 4221258

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide?
The IUPAC name of N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide (CID 650804) is N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide is Cc1cc(NC(=O)c2cccnc2)ccc1NC(=O)c1ccco1.
What is the InChIKey of N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide?
The InChIKey is RHKCPTJIDSINEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O3/c1-12-10-14(20-17(22)13-4-2-8-19-11-13)6-7-15(12)21-18(23)16-5-3-9-24-16/h2-11H,1H3,(H,20,22)(H,21,23).
What are the key properties of N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide?
N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide has a molecular weight of 321.34 g/mol, XLogP of 3.49, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-carbonylamino)-3-methylphenyl]pyridine-3-carboxamide is sourced from PubChem (CID 650804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).