4-(methylamino)pyridine-2-carbonitrile

C7H7N3 — CID 45079907

IUPAC4-(methylamino)pyridine-2-carbonitrile
SMILESCNc1ccnc(C#N)c1
InChIInChI=1S/C7H7N3/c1-9-6-2-3-10-7(4-6)5-8/h2-4H,1H3,(H,9,10)
InChIKeyRWVVYRAAOGBCGM-UHFFFAOYSA-N
MW133.15 g/mol
LogP0.99
Rot. Bonds1

About 4-(methylamino)pyridine-2-carbonitrile

4-(methylamino)pyridine-2-carbonitrile (PubChem CID 45079907) has the molecular formula C7H7N3 and a molecular weight of 133.15 g/mol. Its IUPAC name is 4-(methylamino)pyridine-2-carbonitrile.

Molecular Properties

Compound Name4-(methylamino)pyridine-2-carbonitrile
PubChem CID45079907
Molecular FormulaC7H7N3
Molecular Weight133.15 g/mol
Exact Mass133.06
IUPAC Name4-(methylamino)pyridine-2-carbonitrile
SMILESCNc1ccnc(C#N)c1
InChIInChI=1S/C7H7N3/c1-9-6-2-3-10-7(4-6)5-8/h2-4H,1H3,(H,9,10)
InChIKeyRWVVYRAAOGBCGM-UHFFFAOYSA-N
XLogP0.99
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydrazinylpyridine-2-carbonitrile
CID 62925156
4-[4-(dimethylamino)anilino]pyridine-2-carbonitrile
CID 62925124
4-(4-tert-butylanilino)pyridine-2-carbonitrile
CID 62926534
4-(5-methylhexylamino)pyridine-2-carbonitrile
CID 115325582
4-(2,3-dimethylbutylamino)pyridine-2-carbonitrile
CID 64596884
4-(2-methoxyethylamino)pyridine-2-carbonitrile
CID 62924815
4-[2-(propylamino)ethylamino]pyridine-2-carbonitrile
CID 62926078
4-[(1-methylazetidin-3-yl)amino]pyridine-2-carbonitrile
CID 130670429
4-(1-phenylethylamino)pyridine-2-carbonitrile
CID 62925339
4-[(1-methylpyrazol-4-yl)amino]pyridine-2-carbonitrile
CID 62926735
4-(4-propylanilino)pyridine-2-carbonitrile
CID 62924957
4-(pent-1-yn-3-ylamino)pyridine-2-carbonitrile
CID 106230805

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)pyridine-2-carbonitrile?
The IUPAC name of 4-(methylamino)pyridine-2-carbonitrile (CID 45079907) is 4-(methylamino)pyridine-2-carbonitrile.
What is the SMILES notation for 4-(methylamino)pyridine-2-carbonitrile?
The canonical SMILES for 4-(methylamino)pyridine-2-carbonitrile is CNc1ccnc(C#N)c1.
What is the InChIKey of 4-(methylamino)pyridine-2-carbonitrile?
The InChIKey is RWVVYRAAOGBCGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3/c1-9-6-2-3-10-7(4-6)5-8/h2-4H,1H3,(H,9,10).
What are the key properties of 4-(methylamino)pyridine-2-carbonitrile?
4-(methylamino)pyridine-2-carbonitrile has a molecular weight of 133.15 g/mol, XLogP of 0.99, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)pyridine-2-carbonitrile is sourced from PubChem (CID 45079907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).