2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile

C16H21N3 — CID 55159875

IUPAC2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile
SMILESCc1ccc(C#N)c(N2CCC3(CCCC3)CC2)n1
InChIInChI=1S/C16H21N3/c1-13-4-5-14(12-17)15(18-13)19-10-8-16(9-11-19)6-2-3-7-16/h4-5H,2-3,6-11H2,1H3
InChIKeyMRLSIHVJSDSMQZ-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.42
Rot. Bonds1

About 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile

2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile (PubChem CID 55159875) has the molecular formula C16H21N3 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile
PubChem CID55159875
Molecular FormulaC16H21N3
Molecular Weight255.36 g/mol
Exact Mass255.17
IUPAC Name2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile
SMILESCc1ccc(C#N)c(N2CCC3(CCCC3)CC2)n1
InChIInChI=1S/C16H21N3/c1-13-4-5-14(12-17)15(18-13)19-10-8-16(9-11-19)6-2-3-7-16/h4-5H,2-3,6-11H2,1H3
InChIKeyMRLSIHVJSDSMQZ-UHFFFAOYSA-N
XLogP3.42
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-hydroxy-4-methylazepan-1-yl)-6-methylpyridine-3-carbonitrile
CID 107404520
6-methyl-2-(2-methyl-2,7-diazaspiro[4.5]decan-7-yl)pyridine-3-carbonitrile
CID 56745250
6-methyl-2-(4-methylsulfanylazepan-1-yl)pyridine-3-carbonitrile
CID 114237200
1-(3-cyano-6-methyl-2-pyridinyl)-4-propylpiperidine-4-carboxylic acid
CID 63126361
2-[4-(2-hydroxypropan-2-yl)piperidin-1-yl]-6-methylpyridine-3-carbonitrile
CID 172899335
2-(1,3-dihydroisoindol-2-yl)-6-methylpyridine-3-carbonitrile
CID 62232169
6-methyl-2-(6-oxo-7-propan-2-yl-2,7-diazaspiro[4.5]decan-2-yl)pyridine-3-carbonitrile
CID 72917334
6-methyl-2-[3-(methylamino)pyrrolidin-1-yl]pyridine-3-carbonitrile
CID 115300809
2-[4-(1-cyanopropyl)piperazin-1-yl]-6-methylpyridine-3-carbonitrile
CID 63344062
6-methyl-2-(2-methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)pyridine-3-carbonitrile
CID 57401602
2-[(5S)-7-(cyclopropylmethyl)-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-6-methylpyridine-3-carbonitrile
CID 97151257
2-[3-(methoxymethyl)piperidin-1-yl]-6-methylpyridine-3-carbonitrile
CID 113343675

Frequently Asked Questions

What is the IUPAC name of 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile?
The IUPAC name of 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile (CID 55159875) is 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile.
What is the SMILES notation for 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile?
The canonical SMILES for 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile is Cc1ccc(C#N)c(N2CCC3(CCCC3)CC2)n1.
What is the InChIKey of 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile?
The InChIKey is MRLSIHVJSDSMQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-13-4-5-14(12-17)15(18-13)19-10-8-16(9-11-19)6-2-3-7-16/h4-5H,2-3,6-11H2,1H3.
What are the key properties of 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile?
2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile has a molecular weight of 255.36 g/mol, XLogP of 3.42, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-azaspiro[4.5]decan-8-yl)-6-methylpyridine-3-carbonitrile is sourced from PubChem (CID 55159875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).