N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide

C14H16N2O4S — CID 51330650

IUPACN-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide
SMILESCOCCCNC(=O)c1ccc(NC(=O)c2ccco2)s1
InChIInChI=1S/C14H16N2O4S/c1-19-8-3-7-15-14(18)11-5-6-12(21-11)16-13(17)10-4-2-9-20-10/h2,4-6,9H,3,7-8H2,1H3,(H,15,18)(H,16,17)
InChIKeyJDJGWZKIVCZIJC-UHFFFAOYSA-N
MW308.36 g/mol
LogP2.36
Rot. Bonds7

About N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide

N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide (PubChem CID 51330650) has the molecular formula C14H16N2O4S and a molecular weight of 308.36 g/mol. Its IUPAC name is N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide
PubChem CID51330650
Molecular FormulaC14H16N2O4S
Molecular Weight308.36 g/mol
Exact Mass308.08
IUPAC NameN-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide
SMILESCOCCCNC(=O)c1ccc(NC(=O)c2ccco2)s1
InChIInChI=1S/C14H16N2O4S/c1-19-8-3-7-15-14(18)11-5-6-12(21-11)16-13(17)10-4-2-9-20-10/h2,4-6,9H,3,7-8H2,1H3,(H,15,18)(H,16,17)
InChIKeyJDJGWZKIVCZIJC-UHFFFAOYSA-N
XLogP2.36
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[5-(3-butoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide
CID 31303145
N-(4-methoxybutyl)furan-2-carboxamide
CID 60769533
N-[5-[(2-methoxyphenyl)methylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 31302984
N-[5-[2-(4-bromophenyl)sulfanylethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 38613730
N-[5-[(3,4,5-trimethoxyphenyl)methylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 31309961
N-[5-[(4-methylsulfonylphenyl)methylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 60553481
methyl 2-[[5-(furan-2-carbonylamino)thiophene-2-carbonyl]amino]benzoate
CID 134024119
N-[5-[(2-hydroxycyclopentyl)methylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 111471137
N-[5-[2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 55512143
N-[5-[2-(N-ethyl-3-methylanilino)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 55516916
N-[5-[2-(2-methylbenzimidazol-1-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 31310447
N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 31302572

Frequently Asked Questions

What is the IUPAC name of N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide?
The IUPAC name of N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide (CID 51330650) is N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide is COCCCNC(=O)c1ccc(NC(=O)c2ccco2)s1.
What is the InChIKey of N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide?
The InChIKey is JDJGWZKIVCZIJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4S/c1-19-8-3-7-15-14(18)11-5-6-12(21-11)16-13(17)10-4-2-9-20-10/h2,4-6,9H,3,7-8H2,1H3,(H,15,18)(H,16,17).
What are the key properties of N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide?
N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide has a molecular weight of 308.36 g/mol, XLogP of 2.36, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide is sourced from PubChem (CID 51330650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).