N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide

C14H16N2O2S — CID 53184987

IUPACN-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide
SMILESCOc1ncccc1CN(C)C(=O)c1sccc1C
InChIInChI=1S/C14H16N2O2S/c1-10-6-8-19-12(10)14(17)16(2)9-11-5-4-7-15-13(11)18-3/h4-8H,9H2,1-3H3
InChIKeyBZFOPXMFAVDBDI-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.73
Rot. Bonds4

About N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide

N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide (PubChem CID 53184987) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide
PubChem CID53184987
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide
SMILESCOc1ncccc1CN(C)C(=O)c1sccc1C
InChIInChI=1S/C14H16N2O2S/c1-10-6-8-19-12(10)14(17)16(2)9-11-5-4-7-15-13(11)18-3/h4-8H,9H2,1-3H3
InChIKeyBZFOPXMFAVDBDI-UHFFFAOYSA-N
XLogP2.73
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-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

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide?
The IUPAC name of N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide (CID 53184987) is N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide.
What is the SMILES notation for N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide?
The canonical SMILES for N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide is COc1ncccc1CN(C)C(=O)c1sccc1C.
What is the InChIKey of N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide?
The InChIKey is BZFOPXMFAVDBDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-10-6-8-19-12(10)14(17)16(2)9-11-5-4-7-15-13(11)18-3/h4-8H,9H2,1-3H3.
What are the key properties of N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide?
N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide has a molecular weight of 276.36 g/mol, XLogP of 2.73, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-3-pyridinyl)methyl]-N,3-dimethylthiophene-2-carboxamide is sourced from PubChem (CID 53184987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).