2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide

C14H17N3OS — CID 55047494

IUPAC2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(C)Cc2cccs2)ccn1
InChIInChI=1S/C14H17N3OS/c1-3-15-13-9-11(6-7-16-13)14(18)17(2)10-12-5-4-8-19-12/h4-9H,3,10H2,1-2H3,(H,15,16)
InChIKeyBZNGWLDEZKIUDW-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.85
Rot. Bonds5

About 2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide

2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide (PubChem CID 55047494) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is 2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
PubChem CID55047494
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(C)Cc2cccs2)ccn1
InChIInChI=1S/C14H17N3OS/c1-3-15-13-9-11(6-7-16-13)14(18)17(2)10-12-5-4-8-19-12/h4-9H,3,10H2,1-2H3,(H,15,16)
InChIKeyBZNGWLDEZKIUDW-UHFFFAOYSA-N
XLogP2.85
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-N-methyl-N-[(2-methylphenyl)methyl]pyridine-4-carboxamide
CID 62175582
N,N-diethyl-2-(ethylamino)pyridine-4-carboxamide
CID 62172696
N-[(4-bromothiophen-2-yl)methyl]-N-methyl-2-(methylamino)pyridine-4-carboxamide
CID 62174359
3-ethyl-1-methyl-1-(thiophen-2-ylmethyl)urea
CID 53016484
N-methyl-2-(propylamino)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 62168156
3-amino-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 43527201
2-(ethylamino)-N-(3-hydroxybutyl)-N-methylpyridine-4-carboxamide
CID 115704020
2-(ethylamino)-N,N-dipropylpyridine-4-carboxamide
CID 62167745
N-cyclopropyl-2-hydrazinyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 62242780
3,5-diacetamido-N-methyl-N-(thiophen-2-ylmethyl)benzamide
CID 17429130
N,2,3-trimethyl-N-(thiophen-2-ylmethyl)quinoxaline-6-carboxamide
CID 51205761
N-ethyl-6-(ethylamino)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 62175204

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide (CID 55047494) is 2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide is CCNc1cc(C(=O)N(C)Cc2cccs2)ccn1.
What is the InChIKey of 2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
The InChIKey is BZNGWLDEZKIUDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-3-15-13-9-11(6-7-16-13)14(18)17(2)10-12-5-4-8-19-12/h4-9H,3,10H2,1-2H3,(H,15,16).
What are the key properties of 2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide?
2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide has a molecular weight of 275.38 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-methyl-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide is sourced from PubChem (CID 55047494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).