N-(pyridin-3-ylmethyl)thiophene-3-carboxamide

C11H10N2OS — CID 17015853

IUPACN-(pyridin-3-ylmethyl)thiophene-3-carboxamide
SMILESO=C(NCc1cccnc1)c1ccsc1
InChIInChI=1S/C11H10N2OS/c14-11(10-3-5-15-8-10)13-7-9-2-1-4-12-6-9/h1-6,8H,7H2,(H,13,14)
InChIKeyNJWUDQIXJBWNKS-UHFFFAOYSA-N
MW218.28 g/mol
LogP2.07
Rot. Bonds3

About N-(pyridin-3-ylmethyl)thiophene-3-carboxamide

N-(pyridin-3-ylmethyl)thiophene-3-carboxamide (PubChem CID 17015853) has the molecular formula C11H10N2OS and a molecular weight of 218.28 g/mol. Its IUPAC name is N-(pyridin-3-ylmethyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(pyridin-3-ylmethyl)thiophene-3-carboxamide
PubChem CID17015853
Molecular FormulaC11H10N2OS
Molecular Weight218.28 g/mol
Exact Mass218.05
IUPAC NameN-(pyridin-3-ylmethyl)thiophene-3-carboxamide
SMILESO=C(NCc1cccnc1)c1ccsc1
InChIInChI=1S/C11H10N2OS/c14-11(10-3-5-15-8-10)13-7-9-2-1-4-12-6-9/h1-6,8H,7H2,(H,13,14)
InChIKeyNJWUDQIXJBWNKS-UHFFFAOYSA-N
XLogP2.07
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.28
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(pyridin-3-ylmethyl)pyridine-3-carboxamide;hydrochloride
CID 110755498
N-[(4-hydroxyphenyl)methyl]thiophene-3-carboxamide
CID 47148514
N-[[3-(hydroxymethyl)phenyl]methyl]thiophene-3-carboxamide
CID 55204660
4-(aminomethyl)-N-(pyridin-3-ylmethyl)benzamide
CID 28545926
N-(pyridin-3-ylmethyl)-4-(1,3-thiazol-2-yl)benzamide
CID 110690313
3-(pyridin-3-ylmethylcarbamoyl)benzoic acid
CID 43452921
oxalic acid;1-pyridin-3-yl-N-(thiophen-3-ylmethyl)methanamine
CID 171155059
N-benzylpyridine-3-carboxamide chloride
CID 21204170
6-bromo-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 66463466
N-[[4-(chloromethyl)phenyl]methyl]thiophene-3-carboxamide
CID 107233527
2,3,5,6-tetrafluoro-1-N,4-N-bis(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 1204787
4-(ethylamino)-N-(pyridin-3-ylmethyl)benzamide
CID 62184718

Frequently Asked Questions

What is the IUPAC name of N-(pyridin-3-ylmethyl)thiophene-3-carboxamide?
The IUPAC name of N-(pyridin-3-ylmethyl)thiophene-3-carboxamide (CID 17015853) is N-(pyridin-3-ylmethyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(pyridin-3-ylmethyl)thiophene-3-carboxamide?
The canonical SMILES for N-(pyridin-3-ylmethyl)thiophene-3-carboxamide is O=C(NCc1cccnc1)c1ccsc1.
What is the InChIKey of N-(pyridin-3-ylmethyl)thiophene-3-carboxamide?
The InChIKey is NJWUDQIXJBWNKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2OS/c14-11(10-3-5-15-8-10)13-7-9-2-1-4-12-6-9/h1-6,8H,7H2,(H,13,14).
What are the key properties of N-(pyridin-3-ylmethyl)thiophene-3-carboxamide?
N-(pyridin-3-ylmethyl)thiophene-3-carboxamide has a molecular weight of 218.28 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-3-ylmethyl)thiophene-3-carboxamide is sourced from PubChem (CID 17015853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).