N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide

C17H16N2O3S — CID 31835212

IUPACN-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
SMILESCOc1ccc(C(=O)N(Cc2ccco2)Cc2cccs2)cn1
InChIInChI=1S/C17H16N2O3S/c1-21-16-7-6-13(10-18-16)17(20)19(11-14-4-2-8-22-14)12-15-5-3-9-23-15/h2-10H,11-12H2,1H3
InChIKeyKYPDWAJOWBXCEX-UHFFFAOYSA-N
MW328.39 g/mol
LogP3.59
Rot. Bonds6

About N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide

N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 31835212) has the molecular formula C17H16N2O3S and a molecular weight of 328.39 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
PubChem CID31835212
Molecular FormulaC17H16N2O3S
Molecular Weight328.39 g/mol
Exact Mass328.09
IUPAC NameN-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
SMILESCOc1ccc(C(=O)N(Cc2ccco2)Cc2cccs2)cn1
InChIInChI=1S/C17H16N2O3S/c1-21-16-7-6-13(10-18-16)17(20)19(11-14-4-2-8-22-14)12-15-5-3-9-23-15/h2-10H,11-12H2,1H3
InChIKeyKYPDWAJOWBXCEX-UHFFFAOYSA-N
XLogP3.59
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide (CID 31835212) is N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide is COc1ccc(C(=O)N(Cc2ccco2)Cc2cccs2)cn1.
What is the InChIKey of N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is KYPDWAJOWBXCEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3S/c1-21-16-7-6-13(10-18-16)17(20)19(11-14-4-2-8-22-14)12-15-5-3-9-23-15/h2-10H,11-12H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide has a molecular weight of 328.39 g/mol, XLogP of 3.59, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-6-methoxy-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 31835212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).