5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine

C9H13N5 — CID 19576706

IUPAC5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine
SMILESCc1cnn(Cn2nc(N)cc2C)c1
InChIInChI=1S/C9H13N5/c1-7-4-11-13(5-7)6-14-8(2)3-9(10)12-14/h3-5H,6H2,1-2H3,(H2,10,12)
InChIKeyZDLQEXOAPSPSBU-UHFFFAOYSA-N
MW191.24 g/mol
LogP0.78
Rot. Bonds2

About 5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine

5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine (PubChem CID 19576706) has the molecular formula C9H13N5 and a molecular weight of 191.24 g/mol. Its IUPAC name is 5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine.

Molecular Properties

Compound Name5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine
PubChem CID19576706
Molecular FormulaC9H13N5
Molecular Weight191.24 g/mol
Exact Mass191.12
IUPAC Name5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine
SMILESCc1cnn(Cn2nc(N)cc2C)c1
InChIInChI=1S/C9H13N5/c1-7-4-11-13(5-7)6-14-8(2)3-9(10)12-14/h3-5H,6H2,1-2H3,(H2,10,12)
InChIKeyZDLQEXOAPSPSBU-UHFFFAOYSA-N
XLogP0.78
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.24
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(E)-N1-((1,3-dimethyl-1H-pyrazol-4-yl)methylene)-1H-tetrazole-1,5-diamine
CID 6891021
3-Methyl-2'h-[1,3']bipyrazolyl
CID 12560594
4-Chloro-1-((1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl)-1H-pyrazol-3-amine
CID 7176038
4-Chloro-1-((1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl)-1H-pyrazol-3-amine
CID 7176059
4-chloro-1-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-3-amine
CID 19616393
4-chloro-1-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-3-amine
CID 19616631
N,N,1,3-tetramethyl-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyrazol-5-amine
CID 53569563
N,N,3-trimethyl-1-(2-methylpropyl)-4-[[(2-methylpyrazol-3-yl)methylamino]methyl]pyrazol-5-amine
CID 53603942
2-(1-methylpyrazol-4-yl)-N-[(2-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl)methyl]ethanamine
CID 136196689
N-[(1-methylpyrazol-4-yl)methyl]-1-(2-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl)methanamine
CID 136262563
1,1'-Methylenebis(3-methyl-1H-pyrazole)
CID 15210309
1-methyl-N-[(3-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-3-amine
CID 60808842

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine?
The IUPAC name of 5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine (CID 19576706) is 5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine.
What is the SMILES notation for 5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine?
The canonical SMILES for 5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine is Cc1cnn(Cn2nc(N)cc2C)c1.
What is the InChIKey of 5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine?
The InChIKey is ZDLQEXOAPSPSBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5/c1-7-4-11-13(5-7)6-14-8(2)3-9(10)12-14/h3-5H,6H2,1-2H3,(H2,10,12).
What are the key properties of 5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine?
5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine has a molecular weight of 191.24 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-[(4-methylpyrazol-1-yl)methyl]pyrazol-3-amine is sourced from PubChem (CID 19576706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).