2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide

C13H15N3OS — CID 62159520

IUPAC2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide
SMILESCCC(NC(=O)c1ccnc(N)c1)c1cccs1
InChIInChI=1S/C13H15N3OS/c1-2-10(11-4-3-7-18-11)16-13(17)9-5-6-15-12(14)8-9/h3-8,10H,2H2,1H3,(H2,14,15)(H,16,17)
InChIKeyGRXIWESCXRMJQC-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.61
Rot. Bonds4

About 2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide

2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide (PubChem CID 62159520) has the molecular formula C13H15N3OS and a molecular weight of 261.35 g/mol. Its IUPAC name is 2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide
PubChem CID62159520
Molecular FormulaC13H15N3OS
Molecular Weight261.35 g/mol
Exact Mass261.09
IUPAC Name2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide
SMILESCCC(NC(=O)c1ccnc(N)c1)c1cccs1
InChIInChI=1S/C13H15N3OS/c1-2-10(11-4-3-7-18-11)16-13(17)9-5-6-15-12(14)8-9/h3-8,10H,2H2,1H3,(H2,14,15)(H,16,17)
InChIKeyGRXIWESCXRMJQC-UHFFFAOYSA-N
XLogP2.61
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(1-thiophen-2-ylpropyl)benzamide
CID 54964756
3-amino-N-(1-thiophen-2-ylpropyl)pyrazine-2-carboxamide
CID 119132592
2-amino-N-(1-thiophen-2-ylpropyl)-1,3-benzothiazole-6-carboxamide
CID 65349782
4-chloro-N-(1-thiophen-2-ylpropyl)pyridine-2-carboxamide
CID 47316513
6-chloro-N-(1-thiophen-2-ylpropyl)pyridine-3-carboxamide
CID 47316391
2-amino-N-(3-methylpentan-2-yl)pyridine-4-carboxamide
CID 62160554
N-(1-thiophen-2-ylpropyl)-1H-imidazole-2-carboxamide
CID 131945847
5-(1-thiophen-2-ylpropylcarbamoyl)furan-3-carboxylic acid
CID 113432279
4-(ethylsulfamoyl)-N-(1-thiophen-2-ylpropyl)benzamide
CID 55954354
2-amino-N-hexan-2-ylpyridine-4-carboxamide
CID 62201408
2-(ethylamino)-N-(1-thiophen-2-ylpropyl)pyridine-3-carboxamide
CID 62179628
4-amino-5-methyl-N-(1-thiophen-2-ylpropyl)-1H-pyrazole-3-carboxamide
CID 55034284

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide (CID 62159520) is 2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide is CCC(NC(=O)c1ccnc(N)c1)c1cccs1.
What is the InChIKey of 2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide?
The InChIKey is GRXIWESCXRMJQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3OS/c1-2-10(11-4-3-7-18-11)16-13(17)9-5-6-15-12(14)8-9/h3-8,10H,2H2,1H3,(H2,14,15)(H,16,17).
What are the key properties of 2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide?
2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide has a molecular weight of 261.35 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-thiophen-2-ylpropyl)pyridine-4-carboxamide is sourced from PubChem (CID 62159520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).