N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide

C14H13N3O2S — CID 90511163

IUPACN-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
SMILESO=C(Nc1cccnc1)C1CN(C(=O)c2cccs2)C1
InChIInChI=1S/C14H13N3O2S/c18-13(16-11-3-1-5-15-7-11)10-8-17(9-10)14(19)12-4-2-6-20-12/h1-7,10H,8-9H2,(H,16,18)
InChIKeyVSLKQMVEEYVILO-UHFFFAOYSA-N
MW287.34 g/mol
LogP1.85
Rot. Bonds3

About N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide

N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide (PubChem CID 90511163) has the molecular formula C14H13N3O2S and a molecular weight of 287.34 g/mol. Its IUPAC name is N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide.

Molecular Properties

Compound NameN-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
PubChem CID90511163
Molecular FormulaC14H13N3O2S
Molecular Weight287.34 g/mol
Exact Mass287.07
IUPAC NameN-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
SMILESO=C(Nc1cccnc1)C1CN(C(=O)c2cccs2)C1
InChIInChI=1S/C14H13N3O2S/c18-13(16-11-3-1-5-15-7-11)10-8-17(9-10)14(19)12-4-2-6-20-12/h1-7,10H,8-9H2,(H,16,18)
InChIKeyVSLKQMVEEYVILO-UHFFFAOYSA-N
XLogP1.85
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(difluoromethoxy)phenyl]-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
CID 90511249
6-methyl-N-pyridin-3-yl-8-(thiophene-2-carbonyl)-1-oxa-8-azaspiro[4.5]decane-2-carboxamide
CID 134076540
N-(3,4-dimethoxyphenyl)-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
CID 90511138
N-(4-bromo-3-methylphenyl)-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
CID 90511161
N-(4-morpholin-4-ylphenyl)-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
CID 90511231
N-(2-methylphenyl)-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
CID 90511075
N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 1075464
1-(5-nitrofuran-2-carbonyl)-N-pyridin-3-ylazetidine-3-carboxamide
CID 90512210
N-cyclododecyl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
CID 90511039
piperidin-1-yl-[1-(thiophene-2-carbonyl)azetidin-3-yl]methanone
CID 90510983
[2-(pyridin-3-ylmethyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-thiophen-2-ylmethanone
CID 131646546
N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
CID 90510951

Frequently Asked Questions

What is the IUPAC name of N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide?
The IUPAC name of N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide (CID 90511163) is N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide.
What is the SMILES notation for N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide?
The canonical SMILES for N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide is O=C(Nc1cccnc1)C1CN(C(=O)c2cccs2)C1.
What is the InChIKey of N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide?
The InChIKey is VSLKQMVEEYVILO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2S/c18-13(16-11-3-1-5-15-7-11)10-8-17(9-10)14(19)12-4-2-6-20-12/h1-7,10H,8-9H2,(H,16,18).
What are the key properties of N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide?
N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide has a molecular weight of 287.34 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-3-yl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide is sourced from PubChem (CID 90511163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).