N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide

C17H14N2O3S — CID 655284

IUPACN-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccs2)cc1NC(=O)c1ccco1
InChIInChI=1S/C17H14N2O3S/c1-11-6-7-12(18-17(21)15-5-3-9-23-15)10-13(11)19-16(20)14-4-2-8-22-14/h2-10H,1H3,(H,18,21)(H,19,20)
InChIKeyULWPNYOWSYXXIR-UHFFFAOYSA-N
MW326.38 g/mol
LogP4.15
Rot. Bonds4

About N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide

N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide (PubChem CID 655284) has the molecular formula C17H14N2O3S and a molecular weight of 326.38 g/mol. Its IUPAC name is N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide
PubChem CID655284
Molecular FormulaC17H14N2O3S
Molecular Weight326.38 g/mol
Exact Mass326.07
IUPAC NameN-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide
SMILESCc1ccc(NC(=O)c2cccs2)cc1NC(=O)c1ccco1
InChIInChI=1S/C17H14N2O3S/c1-11-6-7-12(18-17(21)15-5-3-9-23-15)10-13(11)19-16(20)14-4-2-8-22-14/h2-10H,1H3,(H,18,21)(H,19,20)
InChIKeyULWPNYOWSYXXIR-UHFFFAOYSA-N
XLogP4.15
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Furan-2-carboxylic acid [3-methyl-1-(2-thiophen-2-yl-ethyl)-piperidin-4-yl]-phenyl-amide
CID 13653720
N-[(1Z)-3-[(2-methoxyphenyl)amino]-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]furan-2-carboxamide
CID 1591814
5-bromo-N-{3-[(thiophen-2-ylcarbonyl)amino]phenyl}furan-2-carboxamide
CID 1280173
3-Furan-2-ylmethyl-1-(6-methyl-2-oxo-1,2-dihydro-quinolin-3-ylmethyl)-1-thiophen-2-ylmethyl-thiourea
CID 1141373
N-(4,5-dimethylthiophen-2-yl)furan-2-carboxamide
CID 699928
N-(4-phenylthiophen-2-yl)furan-2-carboxamide
CID 699965
N-[4-(phenylsulfanylmethyl)phenyl]furan-2-carboxamide
CID 975641
N-[(1Z)-3-[(4-methoxyphenyl)amino]-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]furan-2-carboxamide
CID 1597340
5-nitro-N-{3-[(2-thienylcarbonyl)amino]phenyl}-2-furamide
CID 1164613
N-(2-furanylmethyl)-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-2-thiophenecarboxamide
CID 666219
N-(4-{[(2-furoylamino)carbothioyl]amino}phenyl)-2-thiophenecarboxamide
CID 1016196
Cambridge id 6246858
CID 1069527

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide?
The IUPAC name of N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide (CID 655284) is N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide is Cc1ccc(NC(=O)c2cccs2)cc1NC(=O)c1ccco1.
What is the InChIKey of N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide?
The InChIKey is ULWPNYOWSYXXIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3S/c1-11-6-7-12(18-17(21)15-5-3-9-23-15)10-13(11)19-16(20)14-4-2-8-22-14/h2-10H,1H3,(H,18,21)(H,19,20).
What are the key properties of N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide?
N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide has a molecular weight of 326.38 g/mol, XLogP of 4.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-(thiophene-2-carbonylamino)phenyl]furan-2-carboxamide is sourced from PubChem (CID 655284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).