6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile

C12H15N3 — CID 162636895

IUPAC6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile
SMILESCc1cc(NCC2CC2)nc(C)c1C#N
InChIInChI=1S/C12H15N3/c1-8-5-12(14-7-10-3-4-10)15-9(2)11(8)6-13/h5,10H,3-4,7H2,1-2H3,(H,14,15)
InChIKeyOISDVOQKPYWLLC-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.39
Rot. Bonds3

About 6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile

6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile (PubChem CID 162636895) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile
PubChem CID162636895
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile
SMILESCc1cc(NCC2CC2)nc(C)c1C#N
InChIInChI=1S/C12H15N3/c1-8-5-12(14-7-10-3-4-10)15-9(2)11(8)6-13/h5,10H,3-4,7H2,1-2H3,(H,14,15)
InChIKeyOISDVOQKPYWLLC-UHFFFAOYSA-N
XLogP2.39
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[[(3S,4S)-3-hydroxypiperidin-4-yl]methylamino]-2,4-dimethylpyridine-3-carbonitrile;dihydrochloride
CID 154910874
2-(cyclopentylmethylamino)-4,6-dimethylpyridine-3-carbonitrile
CID 43428254
6-[(3,3-difluorocyclobutyl)amino]-2,4-dimethylpyridine-3-carbonitrile
CID 163319578
6-[[(2R)-3-(dimethylamino)-2-hydroxypropyl]amino]-2,4-dimethylpyridine-3-carbonitrile
CID 125446747
methyl 4-[(5-cyano-4,6-dimethyl-2-pyridinyl)amino]-4-oxobutanoate
CID 123856199
N-(cyclopropylmethyl)-2,6-dimethylpyrimidin-4-amine
CID 60732015
2,4-dimethyl-6-(3-morpholin-4-ylpropylamino)pyridine-3-carbonitrile
CID 162638269
6-[(3-ethyl-2,3-dimethyl-2-propan-2-ylpentyl)amino]-2,4-dimethylpyridine-3-carbonitrile
CID 142469626
2,4-dimethyl-6-[2-(5-methyl-1H-1,2,4-triazol-3-yl)ethylamino]pyridine-3-carbonitrile
CID 162628237
2-chloro-6-[(3-methylcyclopentyl)methylamino]pyridine-4-carbonitrile
CID 107414806
2-[[6-(cyclohexylmethylamino)-2-methylpyrimidin-4-yl]amino]acetonitrile
CID 115266821
4-[(1-ethylpiperidin-4-yl)methylamino]-2,6-dimethylpyridine-3-carbonitrile
CID 81060937

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile?
The IUPAC name of 6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile (CID 162636895) is 6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile.
What is the SMILES notation for 6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile?
The canonical SMILES for 6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile is Cc1cc(NCC2CC2)nc(C)c1C#N.
What is the InChIKey of 6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile?
The InChIKey is OISDVOQKPYWLLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-8-5-12(14-7-10-3-4-10)15-9(2)11(8)6-13/h5,10H,3-4,7H2,1-2H3,(H,14,15).
What are the key properties of 6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile?
6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile has a molecular weight of 201.27 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethylamino)-2,4-dimethylpyridine-3-carbonitrile is sourced from PubChem (CID 162636895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).