6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile

C17H17N3 — CID 62306461

IUPAC6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile
SMILESCc1ccc(C#N)c(NC2CCCc3ccccc32)n1
InChIInChI=1S/C17H17N3/c1-12-9-10-14(11-18)17(19-12)20-16-8-4-6-13-5-2-3-7-15(13)16/h2-3,5,7,9-10,16H,4,6,8H2,1H3,(H,19,20)
InChIKeyNZKMKPZVOXKAIY-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.75
Rot. Bonds2

About 6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile

6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile (PubChem CID 62306461) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile
PubChem CID62306461
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC Name6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile
SMILESCc1ccc(C#N)c(NC2CCCc3ccccc32)n1
InChIInChI=1S/C17H17N3/c1-12-9-10-14(11-18)17(19-12)20-16-8-4-6-13-5-2-3-7-15(13)16/h2-3,5,7,9-10,16H,4,6,8H2,1H3,(H,19,20)
InChIKeyNZKMKPZVOXKAIY-UHFFFAOYSA-N
XLogP3.75
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)benzene-1,3-dicarbonitrile
CID 133498362
6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyrimidine-4-carbonitrile
CID 107544308
2-bromo-4-(1,2,3,4-tetrahydronaphthalen-1-ylamino)benzonitrile
CID 107276271
4-amino-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]pyrimidine-5-carbonitrile
CID 67456420
5-bromo-3,6-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazin-2-amine
CID 22147500
2-bromo-3-fluoro-4-(1,2,3,4-tetrahydronaphthalen-1-ylamino)benzonitrile
CID 107533583
6-chloro-4,5-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridazin-3-amine
CID 63271648
1,3-dimethyl-5-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyrazole-4-carbonitrile
CID 63756476
4-[2-methyl-6-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]pyrimidin-4-yl]benzonitrile
CID 127034668
5-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyrazine-2-carbonitrile
CID 63659094
2-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrimidin-4-amine
CID 62784380
6-methyl-2-[(2-methylpiperidin-3-yl)amino]pyridine-3-carbonitrile
CID 114695618

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile?
The IUPAC name of 6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile (CID 62306461) is 6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile.
What is the SMILES notation for 6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile?
The canonical SMILES for 6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile is Cc1ccc(C#N)c(NC2CCCc3ccccc32)n1.
What is the InChIKey of 6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile?
The InChIKey is NZKMKPZVOXKAIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-12-9-10-14(11-18)17(19-12)20-16-8-4-6-13-5-2-3-7-15(13)16/h2-3,5,7,9-10,16H,4,6,8H2,1H3,(H,19,20).
What are the key properties of 6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile?
6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile has a molecular weight of 263.34 g/mol, XLogP of 3.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyridine-3-carbonitrile is sourced from PubChem (CID 62306461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).