N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide

C11H8N2O2S — CID 13075816

IUPACN-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide
SMILESN#CC(NC(=O)c1ccco1)c1cccs1
InChIInChI=1S/C11H8N2O2S/c12-7-8(10-4-2-6-16-10)13-11(14)9-3-1-5-15-9/h1-6,8H,(H,13,14)
InChIKeyUYXIRCRKAWKCGZ-UHFFFAOYSA-N
MW232.26 g/mol
LogP2.34
Rot. Bonds3

About N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide

N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide (PubChem CID 13075816) has the molecular formula C11H8N2O2S and a molecular weight of 232.26 g/mol. Its IUPAC name is N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide
PubChem CID13075816
Molecular FormulaC11H8N2O2S
Molecular Weight232.26 g/mol
Exact Mass232.03
IUPAC NameN-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide
SMILESN#CC(NC(=O)c1ccco1)c1cccs1
InChIInChI=1S/C11H8N2O2S/c12-7-8(10-4-2-6-16-10)13-11(14)9-3-1-5-15-9/h1-6,8H,(H,13,14)
InChIKeyUYXIRCRKAWKCGZ-UHFFFAOYSA-N
XLogP2.34
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[cyano(thiophen-2-yl)methyl]-2-fluorobenzamide
CID 13075817
N-[(R)-cyclopentyl(thiophen-2-yl)methyl]furan-2-carboxamide
CID 39032515
2-[3-(furan-2-yl)-3-oxo-1-thiophen-2-ylpropyl]propanedinitrile
CID 14950540
N-[(1R)-1-hydroxy-2-oxo-2-thiophen-2-ylethyl]furan-2-carboxamide
CID 34317354
N-[(1S,2S)-1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide
CID 29181274
N-[1-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 51163296
N-[2-[methyl(1-thiophen-2-ylethyl)amino]-2-oxoethyl]furan-2-carboxamide
CID 47126244
N-[cyano(thiophen-2-yl)methyl]-3-ethylimidazo[1,2-a]pyridine-8-carboxamide
CID 18983827
2-cyano-N-[cyano(thiophen-2-yl)methyl]imidazo[1,2-a]pyridine-8-carboxamide
CID 18983865
N-[(1S,2R)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-1-thiophen-2-ylpropan-2-yl]furan-2-carboxamide
CID 92666028
(2S)-2-(furan-2-carbonylamino)propanoic acid
CID 792932
N-[cyano(thiophen-2-yl)methyl]-2-cyclopentyl-5-methylpyrazole-3-carboxamide
CID 139821332

Frequently Asked Questions

What is the IUPAC name of N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide?
The IUPAC name of N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide (CID 13075816) is N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide?
The canonical SMILES for N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide is N#CC(NC(=O)c1ccco1)c1cccs1.
What is the InChIKey of N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide?
The InChIKey is UYXIRCRKAWKCGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O2S/c12-7-8(10-4-2-6-16-10)13-11(14)9-3-1-5-15-9/h1-6,8H,(H,13,14).
What are the key properties of N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide?
N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide has a molecular weight of 232.26 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyano(thiophen-2-yl)methyl]furan-2-carboxamide is sourced from PubChem (CID 13075816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).