5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile

C15H14N4 — CID 115487706

IUPAC5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile
SMILESCN1CCN(c2ccc(C#N)nc2)c2ccccc21
InChIInChI=1S/C15H14N4/c1-18-8-9-19(15-5-3-2-4-14(15)18)13-7-6-12(10-16)17-11-13/h2-7,11H,8-9H2,1H3
InChIKeyIVCYLDHSTITLEA-UHFFFAOYSA-N
MW250.31 g/mol
LogP2.54
Rot. Bonds1

About 5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile

5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile (PubChem CID 115487706) has the molecular formula C15H14N4 and a molecular weight of 250.31 g/mol. Its IUPAC name is 5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile
PubChem CID115487706
Molecular FormulaC15H14N4
Molecular Weight250.31 g/mol
Exact Mass250.12
IUPAC Name5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile
SMILESCN1CCN(c2ccc(C#N)nc2)c2ccccc21
InChIInChI=1S/C15H14N4/c1-18-8-9-19(15-5-3-2-4-14(15)18)13-7-6-12(10-16)17-11-13/h2-7,11H,8-9H2,1H3
InChIKeyIVCYLDHSTITLEA-UHFFFAOYSA-N
XLogP2.54
TPSA43.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]ethanone
CID 83119857
2-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-4-carbonitrile
CID 55236926
1-(5-bromopyrimidin-2-yl)-4-methyl-2,3-dihydroquinoxaline
CID 63867540
5-[4-(4-aminophenyl)piperazin-1-yl]pyridine-2-carbonitrile
CID 115490476
6-methyl-2-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-3-carbonitrile
CID 63778250
N-methyl-1-[4-(4-methyl-2,3-dihydroquinoxalin-1-yl)phenyl]ethanamine
CID 63776759
5-(4-methylpiperidin-1-yl)pyridine-2-carbonitrile
CID 79839657
5-[4-(1-pyridin-2-ylethyl)piperazin-1-yl]pyridine-2-carbonitrile
CID 86793175
5-morpholin-4-ylpyridine-2-carbonitrile
CID 43811106
5-(4-propan-2-ylpiperazin-1-yl)pyridine-2-carbonitrile
CID 79839573
[4-(4-methyl-2,3-dihydroquinoxalin-1-yl)-2-pyridinyl]methanol
CID 63776596
5-[4-(1-methylimidazol-2-yl)piperazin-1-yl]pyridine-2-carbonitrile
CID 146078102

Frequently Asked Questions

What is the IUPAC name of 5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile?
The IUPAC name of 5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile (CID 115487706) is 5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile.
What is the SMILES notation for 5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile?
The canonical SMILES for 5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile is CN1CCN(c2ccc(C#N)nc2)c2ccccc21.
What is the InChIKey of 5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile?
The InChIKey is IVCYLDHSTITLEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c1-18-8-9-19(15-5-3-2-4-14(15)18)13-7-6-12(10-16)17-11-13/h2-7,11H,8-9H2,1H3.
What are the key properties of 5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile?
5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile has a molecular weight of 250.31 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methyl-2,3-dihydroquinoxalin-1-yl)pyridine-2-carbonitrile is sourced from PubChem (CID 115487706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).