6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile

C11H11N5 — CID 82873499

IUPAC6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile
SMILESCn1ccc(CNc2ccc(C#N)cn2)n1
InChIInChI=1S/C11H11N5/c1-16-5-4-10(15-16)8-14-11-3-2-9(6-12)7-13-11/h2-5,7H,8H2,1H3,(H,13,14)
InChIKeyRBECUTPITGOJRW-UHFFFAOYSA-N
MW213.24 g/mol
LogP1.30
Rot. Bonds3

About 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile

6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile (PubChem CID 82873499) has the molecular formula C11H11N5 and a molecular weight of 213.24 g/mol. Its IUPAC name is 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile
PubChem CID82873499
Molecular FormulaC11H11N5
Molecular Weight213.24 g/mol
Exact Mass213.10
IUPAC Name6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile
SMILESCn1ccc(CNc2ccc(C#N)cn2)n1
InChIInChI=1S/C11H11N5/c1-16-5-4-10(15-16)8-14-11-3-2-9(6-12)7-13-11/h2-5,7H,8H2,1H3,(H,13,14)
InChIKeyRBECUTPITGOJRW-UHFFFAOYSA-N
XLogP1.30
TPSA66.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-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

6-[(4,5-dichloro-1-methylpyrrol-2-yl)methylamino]pyridine-3-carbonitrile
CID 133380342
6-[(3-ethyl-5-methoxy-1-methylpyrazol-4-yl)methylamino]pyridine-3-carbonitrile
CID 133445330
6-[4-[2-hydroxy-4-[(1-methylpyrazol-3-yl)methylamino]benzoyl]piperazin-1-yl]pyridine-3-carbonitrile
CID 166230854
6-chloro-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrimidin-4-amine
CID 82873713
6-[(4-pyrazol-1-ylphenyl)methylamino]pyridine-3-carbonitrile
CID 47053874
6-(3-imidazol-1-ylpropylamino)pyridine-3-carbonitrile
CID 28880579
3-[(1-methylpyrazol-3-yl)methylamino]pyridine-2-carbonitrile
CID 82872539
6-[(4,5-dimethyl-1,3-thiazol-2-yl)methylamino]pyridine-3-carbonitrile
CID 133327002
4-cyano-N-[(1-methylpyrazol-3-yl)methyl]benzenesulfonamide
CID 82873625
6-(2-aminoethylamino)pyridine-3-carbonitrile
CID 11369405
2-[[(5-cyano-2-pyridinyl)amino]methyl]-N,N-dimethylbenzenesulfonamide
CID 30041228
6-N-ethyl-5-methyl-4-N-[(1-methylpyrazol-3-yl)methyl]pyrimidine-4,6-diamine
CID 82874582

Frequently Asked Questions

What is the IUPAC name of 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile?
The IUPAC name of 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile (CID 82873499) is 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile?
The canonical SMILES for 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile is Cn1ccc(CNc2ccc(C#N)cn2)n1.
What is the InChIKey of 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile?
The InChIKey is RBECUTPITGOJRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5/c1-16-5-4-10(15-16)8-14-11-3-2-9(6-12)7-13-11/h2-5,7H,8H2,1H3,(H,13,14).
What are the key properties of 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile?
6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile has a molecular weight of 213.24 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile is sourced from PubChem (CID 82873499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).