N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide

C14H16N2O2S — CID 52906834

IUPACN-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide
SMILESCOCCN(Cc1ccncc1)C(=O)c1ccsc1
InChIInChI=1S/C14H16N2O2S/c1-18-8-7-16(10-12-2-5-15-6-3-12)14(17)13-4-9-19-11-13/h2-6,9,11H,7-8,10H2,1H3
InChIKeySMYQPFHDVZTMKN-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.43
Rot. Bonds6

About N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide

N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide (PubChem CID 52906834) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide
PubChem CID52906834
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide
SMILESCOCCN(Cc1ccncc1)C(=O)c1ccsc1
InChIInChI=1S/C14H16N2O2S/c1-18-8-7-16(10-12-2-5-15-6-3-12)14(17)13-4-9-19-11-13/h2-6,9,11H,7-8,10H2,1H3
InChIKeySMYQPFHDVZTMKN-UHFFFAOYSA-N
XLogP2.43
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-3-pyridin-4-yl-N-(thiophen-3-ylmethyl)propanamide
CID 74240165
4-cyano-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)benzamide
CID 121085063
N-(2-cyanoethyl)-N-(2-methoxyethyl)thiophene-3-carboxamide
CID 63237168
N-(2-methoxyethyl)-3-methyl-4-nitro-N-(pyridin-4-ylmethyl)benzamide
CID 121085114
3-benzyl-1-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)urea
CID 52906852
N-[3-[2-hydroxyethyl(2-methoxyethyl)amino]-3-oxopropyl]thiophene-3-carboxamide
CID 115772753
3-(3,5-dimethylphenyl)-1-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)urea
CID 121085266
N-(2-methoxyethyl)-2-oxo-6-phenyl-N-(pyridin-4-ylmethyl)-1H-pyridine-3-carboxamide
CID 72872777
N-(2-methoxyethyl)-1,6-dimethyl-N-(pyridin-4-ylmethyl)indole-2-carboxamide
CID 77090268
4-(aminomethyl)-N-(2-methoxyethyl)-N-(thiophen-2-ylmethyl)benzamide
CID 60940281
N-[(3,4-dimethoxyphenyl)methyl]-N-ethylthiophene-3-carboxamide
CID 78808460
2-(4-fluorophenyl)sulfanyl-N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)acetamide
CID 121085126

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide (CID 52906834) is N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide is COCCN(Cc1ccncc1)C(=O)c1ccsc1.
What is the InChIKey of N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide?
The InChIKey is SMYQPFHDVZTMKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-18-8-7-16(10-12-2-5-15-6-3-12)14(17)13-4-9-19-11-13/h2-6,9,11H,7-8,10H2,1H3.
What are the key properties of N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide?
N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide has a molecular weight of 276.36 g/mol, XLogP of 2.43, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(pyridin-4-ylmethyl)thiophene-3-carboxamide is sourced from PubChem (CID 52906834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).