N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide

C18H15N3O3 — CID 1262407

IUPACN-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCc1ccnc(NC(=O)c2ccc(NC(=O)c3ccco3)cc2)c1
InChIInChI=1S/C18H15N3O3/c1-12-8-9-19-16(11-12)21-17(22)13-4-6-14(7-5-13)20-18(23)15-3-2-10-24-15/h2-11H,1H3,(H,20,23)(H,19,21,22)
InChIKeyLCNQPGZJMWIHME-UHFFFAOYSA-N
MW321.34 g/mol
LogP3.49
Rot. Bonds4

About N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide

N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide (PubChem CID 1262407) has the molecular formula C18H15N3O3 and a molecular weight of 321.34 g/mol. Its IUPAC name is N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide
PubChem CID1262407
Molecular FormulaC18H15N3O3
Molecular Weight321.34 g/mol
Exact Mass321.11
IUPAC NameN-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide
SMILESCc1ccnc(NC(=O)c2ccc(NC(=O)c3ccco3)cc2)c1
InChIInChI=1S/C18H15N3O3/c1-12-8-9-19-16(11-12)21-17(22)13-4-6-14(7-5-13)20-18(23)15-3-2-10-24-15/h2-11H,1H3,(H,20,23)(H,19,21,22)
InChIKeyLCNQPGZJMWIHME-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

2-methyl-N-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]propanamide
CID 694846
N-[2-(tert-butylamino)-2-oxo-1-(3-pyridyl)ethyl]-N-(4-tert-butylphenyl)furan-2-carboxamide
CID 44634772
N-(2-(furan-2-yl)-3,4''-bipyridin-6-yl)acetamide
CID 46880333
(R)-N-(4-(tert-Butyl)phenyl)-N-(2-(tert-butylamino)-2-oxo-1-(pyridin-3-yl)ethyl)furan-2-carboxamide
CID 46897844
5-[(4-chlorophenoxy)methyl]-N-(4-methyl-2-pyridinyl)-2-furamide
CID 725940
4-ethoxy-N-(4-methylpyridin-2-yl)benzamide
CID 803159
N-(4-butan-2-ylphenyl)-N-[2-(cyclopentylamino)-2-oxo-1-pyridin-3-ylethyl]furan-2-carboxamide
CID 3196508
4-[3-(3-Benzyloxy-pyridin-2-yl)-ureido]-benzamide
CID 11574097
Pyridyl derivative, 15
CID 44520940
N-(2-(furan-2-yl)-3,4''-bipyridin-6-yl)cyclopropanecarboxamide
CID 46866591
N-[5-(3-fluoro-4-pyridinyl)-6-(furan-2-yl)-2-pyridinyl]cyclopropanecarboxamide
CID 46866593
1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxamide
CID 859261

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide (CID 1262407) is N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide is Cc1ccnc(NC(=O)c2ccc(NC(=O)c3ccco3)cc2)c1.
What is the InChIKey of N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is LCNQPGZJMWIHME-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O3/c1-12-8-9-19-16(11-12)21-17(22)13-4-6-14(7-5-13)20-18(23)15-3-2-10-24-15/h2-11H,1H3,(H,20,23)(H,19,21,22).
What are the key properties of N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide?
N-[4-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-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-[(4-methyl-2-pyridinyl)carbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 1262407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).