4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile

C19H18N4 — CID 166360530

IUPAC4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile
SMILESCCc1ccc(CCNc2c(C#N)cnc3cnccc23)cc1
InChIInChI=1S/C19H18N4/c1-2-14-3-5-15(6-4-14)7-10-22-19-16(11-20)12-23-18-13-21-9-8-17(18)19/h3-6,8-9,12-13H,2,7,10H2,1H3,(H,22,23)
InChIKeyWGCDELTWDONTGF-UHFFFAOYSA-N
MW302.38 g/mol
LogP3.72
Rot. Bonds5

About 4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile

4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile (PubChem CID 166360530) has the molecular formula C19H18N4 and a molecular weight of 302.38 g/mol. Its IUPAC name is 4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile.

Molecular Properties

Compound Name4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile
PubChem CID166360530
Molecular FormulaC19H18N4
Molecular Weight302.38 g/mol
Exact Mass302.15
IUPAC Name4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile
SMILESCCc1ccc(CCNc2c(C#N)cnc3cnccc23)cc1
InChIInChI=1S/C19H18N4/c1-2-14-3-5-15(6-4-14)7-10-22-19-16(11-20)12-23-18-13-21-9-8-17(18)19/h3-6,8-9,12-13H,2,7,10H2,1H3,(H,22,23)
InChIKeyWGCDELTWDONTGF-UHFFFAOYSA-N
XLogP3.72
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(propylamino)quinoline-3-carbonitrile
CID 43668866
6-chloro-4-[2-[4-(hydroxymethyl)phenyl]ethylamino]quinoline-3-carbonitrile
CID 133434869
4-[2-(1-methylpyrazol-4-yl)ethylamino]quinoline-3-carbonitrile
CID 80684252
6-ethyl-4-hydrazinylquinoline-3-carbonitrile
CID 62251966
6-(5-hydroxy-3-pyridinyl)-4-(2-phenylethylamino)quinoline-3-carbonitrile
CID 170565419
4-(2-pyrazol-1-ylethylamino)quinoline-3-carbonitrile
CID 61463091
6-bromo-4-(propylamino)quinoline-3-carbonitrile
CID 62190068
4-[2-(1,2,4-oxadiazol-5-yl)ethylamino]quinoline-3-carbonitrile
CID 103744302
3-[(3-cyanoquinolin-4-yl)amino]propanamide
CID 43669033
4-(4-methylpentylamino)quinoline-3-carbonitrile
CID 61038828
4-(3-hydroxypropylamino)quinoline-3-carbonitrile
CID 43668972
6-(2-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-4-(2-phenylethylamino)quinoline-3-carbonitrile
CID 175505841

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile?
The IUPAC name of 4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile (CID 166360530) is 4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile.
What is the SMILES notation for 4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile?
The canonical SMILES for 4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile is CCc1ccc(CCNc2c(C#N)cnc3cnccc23)cc1.
What is the InChIKey of 4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile?
The InChIKey is WGCDELTWDONTGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4/c1-2-14-3-5-15(6-4-14)7-10-22-19-16(11-20)12-23-18-13-21-9-8-17(18)19/h3-6,8-9,12-13H,2,7,10H2,1H3,(H,22,23).
What are the key properties of 4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile?
4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile has a molecular weight of 302.38 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-ethylphenyl)ethylamino]-1,7-naphthyridine-3-carbonitrile is sourced from PubChem (CID 166360530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).