5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine

C8H11N5 — CID 19576822

IUPAC5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine
SMILESCc1cc(N)nn1Cn1cccn1
InChIInChI=1S/C8H11N5/c1-7-5-8(9)11-13(7)6-12-4-2-3-10-12/h2-5H,6H2,1H3,(H2,9,11)
InChIKeyZRUXMNSNUMRLRF-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.48
Rot. Bonds2

About 5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine

5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine (PubChem CID 19576822) has the molecular formula C8H11N5 and a molecular weight of 177.21 g/mol. Its IUPAC name is 5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine.

Molecular Properties

Compound Name5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine
PubChem CID19576822
Molecular FormulaC8H11N5
Molecular Weight177.21 g/mol
Exact Mass177.10
IUPAC Name5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine
SMILESCc1cc(N)nn1Cn1cccn1
InChIInChI=1S/C8H11N5/c1-7-5-8(9)11-13(7)6-12-4-2-3-10-12/h2-5H,6H2,1H3,(H2,9,11)
InChIKeyZRUXMNSNUMRLRF-UHFFFAOYSA-N
XLogP0.48
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-1H-pyrazole-1-carboximidamide
CID 14833242
1H-Pyrazole-1-carboxamide, N,N'-1,4-butanediylbis(3(or 5)-methyl-
CID 3073192
3-Methyl-2'h-[1,3']bipyrazolyl
CID 12560594
3-methyl-1-(pyrimidin-2-yl)-1H-pyrazol-5-amine
CID 43420019
1,1'-Methylenebis(3-methyl-1H-pyrazole)
CID 15210309
1-(4-methylpyrimidin-2-yl)-1H-pyrazol-3-amine
CID 62958582
1-methyl-N-[(3-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-3-amine
CID 60808842
Tris(3-methylpyrazol-1-yl)methane
CID 12054069
1-[Bis(5-methylpyrazol-1-yl)methyl]-5-methylpyrazole
CID 101107320
1-(2,5-Dimethylpyrazol-3-yl)-3-(1-methylpyrazol-4-yl)urea
CID 47363757
Bis[3-(trifluoromethyl)pyrazol-1-yl]methanediamine
CID 59168853
[1-(4-Fluoro-1,5-dimethylpyrazol-3-yl)pyrazol-3-yl]methanamine
CID 70851823

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine?
The IUPAC name of 5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine (CID 19576822) is 5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine.
What is the SMILES notation for 5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine?
The canonical SMILES for 5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine is Cc1cc(N)nn1Cn1cccn1.
What is the InChIKey of 5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine?
The InChIKey is ZRUXMNSNUMRLRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5/c1-7-5-8(9)11-13(7)6-12-4-2-3-10-12/h2-5H,6H2,1H3,(H2,9,11).
What are the key properties of 5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine?
5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine has a molecular weight of 177.21 g/mol, XLogP of 0.48, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(pyrazol-1-ylmethyl)pyrazol-3-amine is sourced from PubChem (CID 19576822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).