1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine

C11H17N5 — CID 7017267

IUPAC1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine
SMILESCc1cc(C)n(Cn2nc(C)c(N)c2C)n1
InChIInChI=1S/C11H17N5/c1-7-5-8(2)15(13-7)6-16-10(4)11(12)9(3)14-16/h5H,6,12H2,1-4H3
InChIKeyLAEGBCUIRWEGAC-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.40
Rot. Bonds2

About 1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine

1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine (PubChem CID 7017267) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is 1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine.

Molecular Properties

Compound Name1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine
PubChem CID7017267
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC Name1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine
SMILESCc1cc(C)n(Cn2nc(C)c(N)c2C)n1
InChIInChI=1S/C11H17N5/c1-7-5-8(2)15(13-7)6-16-10(4)11(12)9(3)14-16/h5H,6,12H2,1-4H3
InChIKeyLAEGBCUIRWEGAC-UHFFFAOYSA-N
XLogP1.40
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1,2-Bis(3,5-dimethylpyrazol-1-yl)ethane
CID 661322
1,1'-(2-butene-1,4-diyl)bis(3,5-dimethyl-1H-pyrazole)
CID 2055740
N,N-bis(3,5-dimethylpyrazol-1-ylmethyl)-cyclohexylamine
CID 404566
N-[2-(3,5-Dimethyl-1H-pyrazol-1-yl)ethyl]-3,5-dimethyl-1H-pyrazole-1-ethanamine
CID 361753
N',N'-bis[(3,5-dimethylpyrazol-1-yl)methyl]-N,N-diethylpropane-1,3-diamine
CID 54576748
1H-Pyrazole, 1,1'-ethylidenebis[3,5-dimethyl-
CID 644841
Tris(3,5-dimethyl-1-pyrazolyl)methane
CID 4359225
1H-Pyrazole, 1,1'-(1,3-dioxo-1,3-digermoxanediyl)bis(methylene)bis(3,5-dimethyl-
CID 3086949
5-methyl-1-{[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}-1H-pyrazol-3-amine
CID 19576915
Bis(1,3,5-trimethylpyrazol-4-yl)diazene
CID 2805548
1-[(3,5-Dimethylpyrazol-1-yl)methyl]-3,5-dimethyl-pyrazole; tetrachlorogold(1-)
CID 49769271
1H-Pyrazole, 1,1'-methylenebis[3,5-dimethyl-
CID 5245492

Frequently Asked Questions

What is the IUPAC name of 1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine?
The IUPAC name of 1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine (CID 7017267) is 1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine.
What is the SMILES notation for 1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine?
The canonical SMILES for 1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine is Cc1cc(C)n(Cn2nc(C)c(N)c2C)n1.
What is the InChIKey of 1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine?
The InChIKey is LAEGBCUIRWEGAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-7-5-8(2)15(13-7)6-16-10(4)11(12)9(3)14-16/h5H,6,12H2,1-4H3.
What are the key properties of 1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine?
1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine has a molecular weight of 219.29 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,5-dimethylpyrazol-1-yl)methyl]-3,5-dimethylpyrazol-4-amine is sourced from PubChem (CID 7017267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).