N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide

C14H15N3OS — CID 32949158

IUPACN-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide
SMILESO=C(Nc1ccc(N2CCCC2)cn1)c1ccsc1
InChIInChI=1S/C14H15N3OS/c18-14(11-5-8-19-10-11)16-13-4-3-12(9-15-13)17-6-1-2-7-17/h3-5,8-10H,1-2,6-7H2,(H,15,16,18)
InChIKeyUFECWMPXPVAAHT-UHFFFAOYSA-N
MW273.36 g/mol
LogP3.00
Rot. Bonds3

About N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide

N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide (PubChem CID 32949158) has the molecular formula C14H15N3OS and a molecular weight of 273.36 g/mol. Its IUPAC name is N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide
PubChem CID32949158
Molecular FormulaC14H15N3OS
Molecular Weight273.36 g/mol
Exact Mass273.09
IUPAC NameN-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide
SMILESO=C(Nc1ccc(N2CCCC2)cn1)c1ccsc1
InChIInChI=1S/C14H15N3OS/c18-14(11-5-8-19-10-11)16-13-4-3-12(9-15-13)17-6-1-2-7-17/h3-5,8-10H,1-2,6-7H2,(H,15,16,18)
InChIKeyUFECWMPXPVAAHT-UHFFFAOYSA-N
XLogP3.00
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide?
The IUPAC name of N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide (CID 32949158) is N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide?
The canonical SMILES for N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide is O=C(Nc1ccc(N2CCCC2)cn1)c1ccsc1.
What is the InChIKey of N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide?
The InChIKey is UFECWMPXPVAAHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3OS/c18-14(11-5-8-19-10-11)16-13-4-3-12(9-15-13)17-6-1-2-7-17/h3-5,8-10H,1-2,6-7H2,(H,15,16,18).
What are the key properties of N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide?
N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide has a molecular weight of 273.36 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-pyrrolidin-1-yl-2-pyridinyl)thiophene-3-carboxamide is sourced from PubChem (CID 32949158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).