6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C19H24N4O3S — CID 158006029

IUPAC6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESCCS(=O)(=O)CC(C)c1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
InChIInChI=1S/C19H24N4O3S/c1-3-27(25,26)12-13(2)15-8-16(10-21-9-15)17-7-14-5-4-6-23(19(20)24)18(14)22-11-17/h7-11,13H,3-6,12H2,1-2H3,(H2,20,24)
InChIKeyFEHNTDSYQMNRAQ-UHFFFAOYSA-N
MW388.49 g/mol
LogP2.51
Rot. Bonds5

About 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 158006029) has the molecular formula C19H24N4O3S and a molecular weight of 388.49 g/mol. Its IUPAC name is 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound Name6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID158006029
Molecular FormulaC19H24N4O3S
Molecular Weight388.49 g/mol
Exact Mass388.16
IUPAC Name6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESCCS(=O)(=O)CC(C)c1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1
InChIInChI=1S/C19H24N4O3S/c1-3-27(25,26)12-13(2)15-8-16(10-21-9-15)17-7-14-5-4-6-23(19(20)24)18(14)22-11-17/h7-11,13H,3-6,12H2,1-2H3,(H2,20,24)
InChIKeyFEHNTDSYQMNRAQ-UHFFFAOYSA-N
XLogP2.51
TPSA106.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide with MolForge

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Related Compounds

1-(4-(3,5-Dimethyl-2,4'-bipyridin-2'-yl)piperazin-1-yl)-3-(methylsulfonyl)propan-1-one
CID 56967595
6-(4-Methyl-pyridin-3-yl)-3,4-dihydro-2H-[1,8]naphthyridine-1-carboxylic acid amide
CID 86272002
6-[5-(2-methylsulfonylphenyl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 86305270
6-[5-[2-(methylsulfamoyl)phenyl]-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 86305320
6-[5-(2-methylsulfonylethyl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 86305372
6-Pyridin-3-yl-3,4-dihydro-2H-[1,8]naphthyridine-1-carboxylic acid amide
CID 86305569
6-(5-fluoro-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 86305615
6-[5-(cyanomethyl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 86305616
6-(5-methylsulfonyl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 86305617
6-(5-phenyl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 86305661
6-[5-(trifluoromethyl)pyridin-3-yl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 86305662
6-(5-methyl-3-pyridinyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
CID 86305667

Frequently Asked Questions

What is the IUPAC name of 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 158006029) is 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is CCS(=O)(=O)CC(C)c1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1.
What is the InChIKey of 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is FEHNTDSYQMNRAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3S/c1-3-27(25,26)12-13(2)15-8-16(10-21-9-15)17-7-14-5-4-6-23(19(20)24)18(14)22-11-17/h7-11,13H,3-6,12H2,1-2H3,(H2,20,24).
What are the key properties of 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 388.49 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(1-ethylsulfonylpropan-2-yl)-3-pyridinyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 158006029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).