2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide

C18H20N2O3S — CID 53167268

IUPAC2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide
SMILESCCCn1ccc2sc(C)c(C(=O)NCc3ccc(C)o3)c2c1=O
InChIInChI=1S/C18H20N2O3S/c1-4-8-20-9-7-14-16(18(20)22)15(12(3)24-14)17(21)19-10-13-6-5-11(2)23-13/h5-7,9H,4,8,10H2,1-3H3,(H,19,21)
InChIKeyHNPMWYPOOOWBHO-UHFFFAOYSA-N
MW344.44 g/mol
LogP3.61
Rot. Bonds5

About 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide

2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide (PubChem CID 53167268) has the molecular formula C18H20N2O3S and a molecular weight of 344.44 g/mol. Its IUPAC name is 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide
PubChem CID53167268
Molecular FormulaC18H20N2O3S
Molecular Weight344.44 g/mol
Exact Mass344.12
IUPAC Name2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide
SMILESCCCn1ccc2sc(C)c(C(=O)NCc3ccc(C)o3)c2c1=O
InChIInChI=1S/C18H20N2O3S/c1-4-8-20-9-7-14-16(18(20)22)15(12(3)24-14)17(21)19-10-13-6-5-11(2)23-13/h5-7,9H,4,8,10H2,1-3H3,(H,19,21)
InChIKeyHNPMWYPOOOWBHO-UHFFFAOYSA-N
XLogP3.61
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide with MolForge

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Related Compounds

N-[(2,4-difluorophenyl)methyl]-2-methyl-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide
CID 53167256
N-[2-(cyclohexen-1-yl)ethyl]-2-methyl-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide
CID 53167250
4-amino-N-[(5-methylfuran-2-yl)methyl]-1-propylpyrrole-2-carboxamide
CID 55081690
2-methyl-N-[(2-methylphenyl)methyl]-4-oxo-5-propylfuro[3,2-c]pyridine-3-carboxamide
CID 71838336
N-[(3-fluorophenyl)methyl]-2-methyl-5-(2-methylpropyl)-4-oxothieno[3,2-c]pyridine-3-carboxamide
CID 53167280
N-[(2-ethoxyphenyl)methyl]-2,5-dimethyl-4-oxothieno[3,2-c]pyridine-3-carboxamide
CID 87051481
2-methyl-5-propyl-3-(4-pyridin-2-ylpiperazine-1-carbonyl)thieno[3,2-c]pyridin-4-one
CID 53167263
2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrazole-3-carboxamide
CID 131933266
N-[(5-methylfuran-2-yl)methyl]-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 46363937
1-[(5-methylfuran-2-yl)methyl]-3-propylimidazol-2-one
CID 116624684
(3aR,5S,6S,7aS)-5,6-dihydroxy-N-[(5-methylfuran-2-yl)methyl]-1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboxamide
CID 119066300
1,5-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrazole-3-carboxamide
CID 39854570

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide (CID 53167268) is 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide is CCCn1ccc2sc(C)c(C(=O)NCc3ccc(C)o3)c2c1=O.
What is the InChIKey of 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide?
The InChIKey is HNPMWYPOOOWBHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3S/c1-4-8-20-9-7-14-16(18(20)22)15(12(3)24-14)17(21)19-10-13-6-5-11(2)23-13/h5-7,9H,4,8,10H2,1-3H3,(H,19,21).
What are the key properties of 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide?
2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide has a molecular weight of 344.44 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(5-methylfuran-2-yl)methyl]-4-oxo-5-propylthieno[3,2-c]pyridine-3-carboxamide is sourced from PubChem (CID 53167268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).