5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide

C13H15N3OS — CID 113436174

IUPAC5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCc2ccsc2)nc1
InChIInChI=1S/C13H15N3OS/c1-2-14-11-3-4-12(15-8-11)13(17)16-7-10-5-6-18-9-10/h3-6,8-9,14H,2,7H2,1H3,(H,16,17)
InChIKeyQRQQPRATLRPUAQ-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.50
Rot. Bonds5

About 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide

5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide (PubChem CID 113436174) has the molecular formula C13H15N3OS and a molecular weight of 261.35 g/mol. Its IUPAC name is 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide
PubChem CID113436174
Molecular FormulaC13H15N3OS
Molecular Weight261.35 g/mol
Exact Mass261.09
IUPAC Name5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCc2ccsc2)nc1
InChIInChI=1S/C13H15N3OS/c1-2-14-11-3-4-12(15-8-11)13(17)16-7-10-5-6-18-9-10/h3-6,8-9,14H,2,7H2,1H3,(H,16,17)
InChIKeyQRQQPRATLRPUAQ-UHFFFAOYSA-N
XLogP2.50
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(ethylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-2-carboxamide
CID 113436186
N-[(4-bromophenyl)methyl]-5-(ethylamino)pyridine-2-carboxamide
CID 104639845
5-(ethylamino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 104639627
5-(ethylamino)-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-2-carboxamide
CID 104641230
N-methyl-5-(propylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide
CID 104640243
5-(ethylamino)-N-methylpyridine-2-carboxamide
CID 104639889
2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 63247950
5-(propylamino)-N-thiophen-3-ylpyridine-2-carboxamide
CID 104641679
5-(ethylamino)-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 104639989
5-(ethylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 104641317
5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide
CID 102908038
5-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 104639698

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide (CID 113436174) is 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide is CCNc1ccc(C(=O)NCc2ccsc2)nc1.
What is the InChIKey of 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide?
The InChIKey is QRQQPRATLRPUAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3OS/c1-2-14-11-3-4-12(15-8-11)13(17)16-7-10-5-6-18-9-10/h3-6,8-9,14H,2,7H2,1H3,(H,16,17).
What are the key properties of 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide?
5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide has a molecular weight of 261.35 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 113436174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).