2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide

C11H10ClN3OS — CID 114922128

IUPAC2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)NCc2cccs2)c(Cl)cn1
InChIInChI=1S/C11H10ClN3OS/c12-9-6-14-10(13)4-8(9)11(16)15-5-7-2-1-3-17-7/h1-4,6H,5H2,(H2,13,14)(H,15,16)
InChIKeyOYPUUZBCLUVYMK-UHFFFAOYSA-N
MW267.74 g/mol
LogP2.31
Rot. Bonds3

About 2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide

2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide (PubChem CID 114922128) has the molecular formula C11H10ClN3OS and a molecular weight of 267.74 g/mol. Its IUPAC name is 2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
PubChem CID114922128
Molecular FormulaC11H10ClN3OS
Molecular Weight267.74 g/mol
Exact Mass267.02
IUPAC Name2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)NCc2cccs2)c(Cl)cn1
InChIInChI=1S/C11H10ClN3OS/c12-9-6-14-10(13)4-8(9)11(16)15-5-7-2-1-3-17-7/h1-4,6H,5H2,(H2,13,14)(H,15,16)
InChIKeyOYPUUZBCLUVYMK-UHFFFAOYSA-N
XLogP2.31
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.74
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-5-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-4-carboxamide
CID 114922785
2-amino-5-chloro-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-4-carboxamide
CID 114923513
1-amino-N-(thiophen-2-ylmethyl)isoquinoline-4-carboxamide
CID 106770448
2-amino-5-chloro-N-[(3-chloro-4-fluorophenyl)methyl]pyridine-4-carboxamide
CID 114923313
2-amino-5-chloro-N-[(6-methyl-3-pyridinyl)methyl]pyridine-4-carboxamide
CID 114923423
2-amino-5-chloro-N-methylpyridine-4-carboxamide
CID 114921748
2-amino-5-chloro-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide
CID 106377371
2-amino-N-(1,3-benzodioxol-5-ylmethyl)-5-chloropyridine-4-carboxamide
CID 114923373
5-[(2-amino-2-methylpropanoyl)amino]-2-chloro-N-(thiophen-2-ylmethyl)benzamide
CID 119342331
2-chloro-5-nitro-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 103803189
4-amino-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 62153900
4,5-dichloro-N-(thiophen-2-ylmethyl)thiophene-2-carboxamide
CID 110186920

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide (CID 114922128) is 2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide is Nc1cc(C(=O)NCc2cccs2)c(Cl)cn1.
What is the InChIKey of 2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
The InChIKey is OYPUUZBCLUVYMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3OS/c12-9-6-14-10(13)4-8(9)11(16)15-5-7-2-1-3-17-7/h1-4,6H,5H2,(H2,13,14)(H,15,16).
What are the key properties of 2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide has a molecular weight of 267.74 g/mol, XLogP of 2.31, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide is sourced from PubChem (CID 114922128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).