3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide

C10H8ClN3OS — CID 103093844

IUPAC3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide
SMILESNc1ccsc1C(=O)Nc1ncccc1Cl
InChIInChI=1S/C10H8ClN3OS/c11-6-2-1-4-13-9(6)14-10(15)8-7(12)3-5-16-8/h1-5H,12H2,(H,13,14,15)
InChIKeyPQRNYRMSOWSPOC-UHFFFAOYSA-N
MW253.71 g/mol
LogP2.63
Rot. Bonds2

About 3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide

3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide (PubChem CID 103093844) has the molecular formula C10H8ClN3OS and a molecular weight of 253.71 g/mol. Its IUPAC name is 3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide
PubChem CID103093844
Molecular FormulaC10H8ClN3OS
Molecular Weight253.71 g/mol
Exact Mass253.01
IUPAC Name3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide
SMILESNc1ccsc1C(=O)Nc1ncccc1Cl
InChIInChI=1S/C10H8ClN3OS/c11-6-2-1-4-13-9(6)14-10(15)8-7(12)3-5-16-8/h1-5H,12H2,(H,13,14,15)
InChIKeyPQRNYRMSOWSPOC-UHFFFAOYSA-N
XLogP2.63
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.71
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(3-chloro-2-pyridinyl)pyridine-2-carboxamide
CID 103094260
N-(3-chloro-2-pyridinyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 103892877
2-amino-N-(3-chloro-2-pyridinyl)-1,3-thiazole-4-carboxamide
CID 103094302
3-amino-N-(1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 61090146
3-amino-N-(5-chloro-2-pyridinyl)thiophene-2-carboxamide
CID 61094139
3-amino-N-(4-chlorophenyl)thiophene-2-carboxamide
CID 61092440
2-chloro-N-(3-chloro-2-pyridinyl)pyridine-3-carboxamide
CID 103892911
5-chloro-N-(3-chloro-2-pyridinyl)-1,3,4-thiadiazole-2-carboxamide
CID 103094101
5-amino-2-bromo-N-(3-chloro-2-pyridinyl)-4-fluorobenzamide
CID 103093873
4-amino-N-(3-chloro-2-pyridinyl)-3-nitrobenzamide
CID 103094802
2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide
CID 103093864
methyl N-(3-chloro-2-pyridinyl)carbamate
CID 103094493

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide?
The IUPAC name of 3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide (CID 103093844) is 3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide?
The canonical SMILES for 3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide is Nc1ccsc1C(=O)Nc1ncccc1Cl.
What is the InChIKey of 3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide?
The InChIKey is PQRNYRMSOWSPOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3OS/c11-6-2-1-4-13-9(6)14-10(15)8-7(12)3-5-16-8/h1-5H,12H2,(H,13,14,15).
What are the key properties of 3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide?
3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide has a molecular weight of 253.71 g/mol, XLogP of 2.63, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-chloro-2-pyridinyl)thiophene-2-carboxamide is sourced from PubChem (CID 103093844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).