3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile

C16H16N4 — CID 103468438

IUPAC3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile
SMILESCC1Cc2ccccc2N(c2ccc(N)c(C#N)n2)C1
InChIInChI=1S/C16H16N4/c1-11-8-12-4-2-3-5-15(12)20(10-11)16-7-6-13(18)14(9-17)19-16/h2-7,11H,8,10,18H2,1H3
InChIKeyCYFGCAUBPKSRQV-UHFFFAOYSA-N
MW264.33 g/mol
LogP2.87
Rot. Bonds1

About 3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile

3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile (PubChem CID 103468438) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is 3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile.

Molecular Properties

Compound Name3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile
PubChem CID103468438
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC Name3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile
SMILESCC1Cc2ccccc2N(c2ccc(N)c(C#N)n2)C1
InChIInChI=1S/C16H16N4/c1-11-8-12-4-2-3-5-15(12)20(10-11)16-7-6-13(18)14(9-17)19-16/h2-7,11H,8,10,18H2,1H3
InChIKeyCYFGCAUBPKSRQV-UHFFFAOYSA-N
XLogP2.87
TPSA65.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile?
The IUPAC name of 3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile (CID 103468438) is 3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile.
What is the SMILES notation for 3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile?
The canonical SMILES for 3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile is CC1Cc2ccccc2N(c2ccc(N)c(C#N)n2)C1.
What is the InChIKey of 3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile?
The InChIKey is CYFGCAUBPKSRQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-11-8-12-4-2-3-5-15(12)20(10-11)16-7-6-13(18)14(9-17)19-16/h2-7,11H,8,10,18H2,1H3.
What are the key properties of 3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile?
3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile has a molecular weight of 264.33 g/mol, XLogP of 2.87, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)pyridine-2-carbonitrile is sourced from PubChem (CID 103468438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).