3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine

C10H21N5 — CID 103078310

IUPAC3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine
SMILESCN(C)C(C)(C)CNc1nn(C)cc1N
InChIInChI=1S/C10H21N5/c1-10(2,14(3)4)7-12-9-8(11)6-15(5)13-9/h6H,7,11H2,1-5H3,(H,12,13)
InChIKeyDUZNQCNXGDWMPY-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.75
Rot. Bonds4

About 3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine

3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine (PubChem CID 103078310) has the molecular formula C10H21N5 and a molecular weight of 211.31 g/mol. Its IUPAC name is 3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine.

Molecular Properties

Compound Name3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine
PubChem CID103078310
Molecular FormulaC10H21N5
Molecular Weight211.31 g/mol
Exact Mass211.18
IUPAC Name3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine
SMILESCN(C)C(C)(C)CNc1nn(C)cc1N
InChIInChI=1S/C10H21N5/c1-10(2,14(3)4)7-12-9-8(11)6-15(5)13-9/h6H,7,11H2,1-5H3,(H,12,13)
InChIKeyDUZNQCNXGDWMPY-UHFFFAOYSA-N
XLogP0.75
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N,2-N,2-trimethyl-1-N-(1-methyl-4-nitropyrazol-3-yl)propane-1,2-diamine
CID 103079835
4-amino-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3-carboxamide
CID 65354139
3-N-tert-butyl-1-methylpyrazole-3,4-diamine
CID 103077897
3-N-(3-fluoro-3-methylbutyl)-1-methylpyrazole-3,4-diamine
CID 164654726
3-N-butyl-1-methylpyrazole-3,4-diamine
CID 90481031
3-N-[1-(dimethylamino)-4-methylpentan-2-yl]-1-methylpyrazole-3,4-diamine
CID 103078240
3-N,1-dimethyl-3-N-(2-methylbutan-2-yl)pyrazole-3,4-diamine
CID 103078545
1-methyl-3-N-(3-methylsulfinylbutyl)pyrazole-3,4-diamine
CID 103078897
3-[[(4-amino-1-methylpyrazol-3-yl)amino]methyl]cyclobutan-1-ol
CID 103078653
1-[[(4-amino-1-methylpyrazol-3-yl)amino]methyl]cyclobutan-1-ol
CID 103078928
1-N-[(4-bromo-1-methylpyrazol-3-yl)methyl]-2-N,2-N,2-trimethylpropane-1,2-diamine
CID 138030401
1-methyl-3-N-(oxan-4-ylmethyl)pyrazole-3,4-diamine
CID 103078529

Frequently Asked Questions

What is the IUPAC name of 3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine?
The IUPAC name of 3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine (CID 103078310) is 3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine.
What is the SMILES notation for 3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine?
The canonical SMILES for 3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine is CN(C)C(C)(C)CNc1nn(C)cc1N.
What is the InChIKey of 3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine?
The InChIKey is DUZNQCNXGDWMPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N5/c1-10(2,14(3)4)7-12-9-8(11)6-15(5)13-9/h6H,7,11H2,1-5H3,(H,12,13).
What are the key properties of 3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine?
3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine has a molecular weight of 211.31 g/mol, XLogP of 0.75, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-[2-(dimethylamino)-2-methylpropyl]-1-methylpyrazole-3,4-diamine is sourced from PubChem (CID 103078310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).