N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide

C10H13N3O2S — CID 61254641

IUPACN-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide
SMILESNC(=O)c1ccsc1NC(=O)C1CCCN1
InChIInChI=1S/C10H13N3O2S/c11-8(14)6-3-5-16-10(6)13-9(15)7-2-1-4-12-7/h3,5,7,12H,1-2,4H2,(H2,11,14)(H,13,15)
InChIKeyPVUZASIUORJGDV-UHFFFAOYSA-N
MW239.30 g/mol
LogP0.54
Rot. Bonds3

About N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide

N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide (PubChem CID 61254641) has the molecular formula C10H13N3O2S and a molecular weight of 239.30 g/mol. Its IUPAC name is N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide
PubChem CID61254641
Molecular FormulaC10H13N3O2S
Molecular Weight239.30 g/mol
Exact Mass239.07
IUPAC NameN-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide
SMILESNC(=O)c1ccsc1NC(=O)C1CCCN1
InChIInChI=1S/C10H13N3O2S/c11-8(14)6-3-5-16-10(6)13-9(15)7-2-1-4-12-7/h3,5,7,12H,1-2,4H2,(H2,11,14)(H,13,15)
InChIKeyPVUZASIUORJGDV-UHFFFAOYSA-N
XLogP0.54
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.30
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-(pyrrolidine-2-carbonylamino)thiophene-3-carboxylate
CID 60717312
2,2,2-trichloroethyl 2-[[(2S)-pyrrolidine-2-carbonyl]amino]thiophene-3-carboxylate
CID 171346399
N-thiophen-2-ylpyrrolidine-2-carboxamide
CID 115159164
N-(3-carbamoyl-4-fluorophenyl)pyrrolidine-2-carboxamide
CID 43432164
(2R)-N-[4-(carbamoylamino)phenyl]pyrrolidine-2-carboxamide
CID 103794450
N-(3-carbamoyl-4-methylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119316570
(2S)-N-(4-carbamoyl-3-chlorophenyl)piperidine-2-carboxamide
CID 103808831
N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide
CID 115626531
N-(4-aminophenyl)pyrrolidine-2-carboxamide
CID 22034800
N-(3-carbamoylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119270285
(2R)-N-(3-carbamoyl-4-fluorophenyl)piperidine-2-carboxamide
CID 103808664
2-[3-(cyclopropylamino)propanoylamino]thiophene-3-carboxamide
CID 61253475

Frequently Asked Questions

What is the IUPAC name of N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide (CID 61254641) is N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide is NC(=O)c1ccsc1NC(=O)C1CCCN1.
What is the InChIKey of N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide?
The InChIKey is PVUZASIUORJGDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2S/c11-8(14)6-3-5-16-10(6)13-9(15)7-2-1-4-12-7/h3,5,7,12H,1-2,4H2,(H2,11,14)(H,13,15).
What are the key properties of N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide?
N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide has a molecular weight of 239.30 g/mol, XLogP of 0.54, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbamoylthiophen-2-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 61254641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).