5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile

C15H15N3 — CID 115487645

IUPAC5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile
SMILESCc1cc(C)cc(N(C)c2ccc(C#N)nc2)c1
InChIInChI=1S/C15H15N3/c1-11-6-12(2)8-15(7-11)18(3)14-5-4-13(9-16)17-10-14/h4-8,10H,1-3H3
InChIKeyUMKNUVQOTHNGCS-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.34
Rot. Bonds2

About 5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile

5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile (PubChem CID 115487645) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile
PubChem CID115487645
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile
SMILESCc1cc(C)cc(N(C)c2ccc(C#N)nc2)c1
InChIInChI=1S/C15H15N3/c1-11-6-12(2)8-15(7-11)18(3)14-5-4-13(9-16)17-10-14/h4-8,10H,1-3H3
InChIKeyUMKNUVQOTHNGCS-UHFFFAOYSA-N
XLogP3.34
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-ethyl-N-methylanilino)pyridine-2-carbonitrile
CID 115487644
1-[5-(N,3,5-trimethylanilino)-2-pyridinyl]ethanone
CID 83119952
5-[methyl(propan-2-yl)amino]pyridine-2-carbonitrile
CID 115487439
ethane;5-methylpyridine-2-carbonitrile
CID 143546182
5-[bis(trimethylsilyl)amino]pyridine-2-carbonitrile
CID 66606827
ethane;methoxymethane;5-methylpyridine-2-carbonitrile
CID 176990243
5-[2-cyanopropyl(methyl)amino]pyridine-2-carbonitrile
CID 115487373
4-[(N,3,5-trimethylanilino)methyl]pyridine-2-carbonitrile
CID 63884612
5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile
CID 130563574
3,5-difluoro-4-(N,3,5-trimethylanilino)benzonitrile
CID 81283403
5-[(5-amino-2-chlorophenyl)methyl-methylamino]pyridine-2-carbonitrile
CID 115490495
6-cyano-N-(3,5-dimethylphenyl)pyridine-3-sulfonamide
CID 115602138

Frequently Asked Questions

What is the IUPAC name of 5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile?
The IUPAC name of 5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile (CID 115487645) is 5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile.
What is the SMILES notation for 5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile?
The canonical SMILES for 5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile is Cc1cc(C)cc(N(C)c2ccc(C#N)nc2)c1.
What is the InChIKey of 5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile?
The InChIKey is UMKNUVQOTHNGCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-11-6-12(2)8-15(7-11)18(3)14-5-4-13(9-16)17-10-14/h4-8,10H,1-3H3.
What are the key properties of 5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile?
5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile has a molecular weight of 237.31 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(N,3,5-trimethylanilino)pyridine-2-carbonitrile is sourced from PubChem (CID 115487645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).