N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide

C13H14N2O2S2 — CID 2837035

IUPACN-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide
SMILESCC(CNC(=O)c1cccs1)NC(=O)c1cccs1
InChIInChI=1S/C13H14N2O2S2/c1-9(15-13(17)11-5-3-7-19-11)8-14-12(16)10-4-2-6-18-10/h2-7,9H,8H2,1H3,(H,14,16)(H,15,17)
InChIKeyCLHVYGGATNPCNM-UHFFFAOYSA-N
MW294.40 g/mol
LogP2.36
Rot. Bonds5

About N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide

N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide (PubChem CID 2837035) has the molecular formula C13H14N2O2S2 and a molecular weight of 294.40 g/mol. Its IUPAC name is N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide
PubChem CID2837035
Molecular FormulaC13H14N2O2S2
Molecular Weight294.40 g/mol
Exact Mass294.05
IUPAC NameN-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide
SMILESCC(CNC(=O)c1cccs1)NC(=O)c1cccs1
InChIInChI=1S/C13H14N2O2S2/c1-9(15-13(17)11-5-3-7-19-11)8-14-12(16)10-4-2-6-18-10/h2-7,9H,8H2,1H3,(H,14,16)(H,15,17)
InChIKeyCLHVYGGATNPCNM-UHFFFAOYSA-N
XLogP2.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-hydroxybutan-2-yl)thiophene-2-carboxamide
CID 81041290
N-(3-methyl-2-propan-2-ylbutyl)thiophene-2-carboxamide
CID 102908401
N-[(2S)-1-methoxypropan-2-yl]thiophene-2-carboxamide
CID 670280
N-(1-aminooxypropan-2-yl)thiophene-2-carboxamide
CID 82040114
methyl 2-amino-3-(thiophene-2-carbonylamino)propanoate
CID 22661369
N-[2-[[(2S)-1-aminopropan-2-yl]amino]-2-oxoethyl]thiophene-2-carboxamide;hydrochloride
CID 120506210
2-methyl-6-(thiophene-2-carbonylamino)heptanoic acid
CID 65285828
N-[(2R)-1-amino-1-oxopropan-2-yl]thiophene-2-carboxamide
CID 130174839
N-(2-bromo-4,4-dimethylpentyl)thiophene-2-carboxamide
CID 107156721
N-(2-amino-2-cyclopropylethyl)thiophene-2-carboxamide
CID 115301080
methyl 2-(thiophene-2-carbonylamino)propanoate
CID 531387
5-chloro-N-[2-[(5-chlorothiophene-2-carbonyl)amino]propyl]thiophene-2-carboxamide
CID 3490004

Frequently Asked Questions

What is the IUPAC name of N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide (CID 2837035) is N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide is CC(CNC(=O)c1cccs1)NC(=O)c1cccs1.
What is the InChIKey of N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide?
The InChIKey is CLHVYGGATNPCNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S2/c1-9(15-13(17)11-5-3-7-19-11)8-14-12(16)10-4-2-6-18-10/h2-7,9H,8H2,1H3,(H,14,16)(H,15,17).
What are the key properties of N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide?
N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide has a molecular weight of 294.40 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(thiophene-2-carbonylamino)propyl]thiophene-2-carboxamide is sourced from PubChem (CID 2837035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).