5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine

C13H18N4 — CID 103824003

IUPAC5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine
SMILESCc1cncc(NCc2cnn(C(C)C)c2)c1
InChIInChI=1S/C13H18N4/c1-10(2)17-9-12(7-16-17)6-15-13-4-11(3)5-14-8-13/h4-5,7-10,15H,6H2,1-3H3
InChIKeyOZKPZJJIRKQGSC-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.78
Rot. Bonds4

About 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine

5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine (PubChem CID 103824003) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine
PubChem CID103824003
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine
SMILESCc1cncc(NCc2cnn(C(C)C)c2)c1
InChIInChI=1S/C13H18N4/c1-10(2)17-9-12(7-16-17)6-15-13-4-11(3)5-14-8-13/h4-5,7-10,15H,6H2,1-3H3
InChIKeyOZKPZJJIRKQGSC-UHFFFAOYSA-N
XLogP2.78
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine 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

3-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]aniline
CID 103720504
3-bromo-4-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]aniline
CID 103818279
6-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine
CID 103816369
4-iodo-N-[(1-propan-2-ylpyrazol-4-yl)methyl]aniline
CID 103825724
N-[(1-propan-2-ylpyrazol-4-yl)methyl]-4-propylaniline
CID 103817805
3-chloro-5-fluoro-N-[(1-propan-2-ylpyrazol-4-yl)methyl]aniline
CID 103818393
4-[[(5-methyl-3-pyridinyl)amino]methyl]benzonitrile
CID 113278299
N-[(1-propan-2-ylpyrazol-4-yl)methyl]-4-(trifluoromethyl)aniline
CID 103825746
N-[(3,4-dibromophenyl)methyl]-1-propan-2-ylpyrazol-4-amine
CID 115881219
N-[(1-propan-2-ylpyrazol-4-yl)methyl]propan-2-amine
CID 61270976
5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine
CID 104599634
5-methyl-N-[(1-methyl-3-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine
CID 103823917

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine?
The IUPAC name of 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine (CID 103824003) is 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine?
The canonical SMILES for 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine is Cc1cncc(NCc2cnn(C(C)C)c2)c1.
What is the InChIKey of 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine?
The InChIKey is OZKPZJJIRKQGSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-10(2)17-9-12(7-16-17)6-15-13-4-11(3)5-14-8-13/h4-5,7-10,15H,6H2,1-3H3.
What are the key properties of 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine?
5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine has a molecular weight of 230.31 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 103824003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).