N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide

C15H16N2OS — CID 110461992

IUPACN-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide
SMILESO=C(NC1CCN(c2ccccc2)C1)c1cccs1
InChIInChI=1S/C15H16N2OS/c18-15(14-7-4-10-19-14)16-12-8-9-17(11-12)13-5-2-1-3-6-13/h1-7,10,12H,8-9,11H2,(H,16,18)
InChIKeyQNWVTXBKFHCNPN-UHFFFAOYSA-N
MW272.37 g/mol
LogP2.76
Rot. Bonds3

About N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide

N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide (PubChem CID 110461992) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide
PubChem CID110461992
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC NameN-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide
SMILESO=C(NC1CCN(c2ccccc2)C1)c1cccs1
InChIInChI=1S/C15H16N2OS/c18-15(14-7-4-10-19-14)16-12-8-9-17(11-12)13-5-2-1-3-6-13/h1-7,10,12H,8-9,11H2,(H,16,18)
InChIKeyQNWVTXBKFHCNPN-UHFFFAOYSA-N
XLogP2.76
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]thiophene-2-carboxamide
CID 7255002
N-[1-[2-(cyclopropylcarbamoyl)phenyl]piperidin-4-yl]thiophene-2-carboxamide
CID 46156012
1-cyclopropyl-3-[(3S)-1-phenylpyrrolidin-3-yl]urea
CID 95312527
N-[1-(cyclopentanecarbonyl)pyrrolidin-3-yl]thiophene-2-carboxamide
CID 53016414
N-cyclopropyl-4-(thiophene-2-carbonylamino)piperidine-1-carboxamide
CID 47386196
N-[1-(1,2,5-thiadiazol-3-yl)piperidin-4-yl]thiophene-2-carboxamide
CID 126851164
N-[(3S)-1-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]pyrrolidin-3-yl]thiophene-2-carboxamide
CID 99741546
4-iodo-3-[(1-phenylpyrrolidin-3-yl)carbamoyl]benzoic acid
CID 166396641
N-[1-(1-methyl-6-oxopyridazin-4-yl)piperidin-4-yl]thiophene-2-carboxamide
CID 91924014
1,1-dimethyl-3-(1-phenylpyrrolidin-3-yl)urea
CID 110459954
N-[(3S)-1-phenylpyrrolidin-3-yl]pyrrolidine-1-carboxamide
CID 95155812
tert-butyl 3-(thiophene-2-carbonylamino)pyrrolidine-1-carboxylate
CID 71629640

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide?
The IUPAC name of N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide (CID 110461992) is N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide is O=C(NC1CCN(c2ccccc2)C1)c1cccs1.
What is the InChIKey of N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide?
The InChIKey is QNWVTXBKFHCNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c18-15(14-7-4-10-19-14)16-12-8-9-17(11-12)13-5-2-1-3-6-13/h1-7,10,12H,8-9,11H2,(H,16,18).
What are the key properties of N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide?
N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide has a molecular weight of 272.37 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylpyrrolidin-3-yl)thiophene-2-carboxamide is sourced from PubChem (CID 110461992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).