5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine

C15H23N5 — CID 106759506

IUPAC5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
SMILESCc1nn(C(C)C)c(Nc2ccccc2N(C)C)c1N
InChIInChI=1S/C15H23N5/c1-10(2)20-15(14(16)11(3)18-20)17-12-8-6-7-9-13(12)19(4)5/h6-10,17H,16H2,1-5H3
InChIKeyRHPSVKMPWBUWOR-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.16
Rot. Bonds4

About 5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine

5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine (PubChem CID 106759506) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
PubChem CID106759506
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine
SMILESCc1nn(C(C)C)c(Nc2ccccc2N(C)C)c1N
InChIInChI=1S/C15H23N5/c1-10(2)20-15(14(16)11(3)18-20)17-12-8-6-7-9-13(12)19(4)5/h6-10,17H,16H2,1-5H3
InChIKeyRHPSVKMPWBUWOR-UHFFFAOYSA-N
XLogP3.16
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-Amino-3-methyl-1-phenylpyrazole
CID 70801
3-methyl-N,1-diphenyl-1H-pyrazol-5-amine
CID 867748
5-Methyl-2-phenyl-4-phenylazo-2H-pyrazol-3-ylamine
CID 3112358
2-Ethyl-7-fluoro-10-(4-methyl-piperazin-1-yl)-2,4-dihydro-1,2,3,4,9-pentaaza-benzo[f]azulene
CID 135797568
7-Fluoro-2-methyl-10-(4-methyl-piperazin-1-yl)-2,4-dihydro-1,2,3,4,9-pentaaza-benzo[f]azulene
CID 135797569
2-Methyl-10-(4-methyl-piperazin-1-yl)-2,4-dihydro-1,2,3,4,9-pentaaza-benzo[f]azulene
CID 135797581
N-[2-(2-cyanoethyl)-5-methyl-3-pyrazolyl]-N''-methylbenzenecarboximidamide
CID 2324502
1H-Pyrazol-5-amine, 1-ethyl-3-methyl-N-phenyl-
CID 2356878
2-Methyl-10-(4-methyl-piperazin-1-yl)-2,4-dihydro-2,3,4,9-tetraaza-benzo[f]azulene
CID 135759093
7-Fluoro-1,2-dimethyl-10-(4-methyl-piperazin-1-yl)-2,4-dihydro-2,3,4,9-tetraaza-benzo[f]azulene
CID 135759111
1-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)piperazine
CID 22029039
4-bromo-N-(4-bromophenyl)-1-ethyl-3-methylpyrazol-5-amine
CID 2356923

Frequently Asked Questions

What is the IUPAC name of 5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine?
The IUPAC name of 5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine (CID 106759506) is 5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine.
What is the SMILES notation for 5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine?
The canonical SMILES for 5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine is Cc1nn(C(C)C)c(Nc2ccccc2N(C)C)c1N.
What is the InChIKey of 5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine?
The InChIKey is RHPSVKMPWBUWOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-10(2)20-15(14(16)11(3)18-20)17-12-8-6-7-9-13(12)19(4)5/h6-10,17H,16H2,1-5H3.
What are the key properties of 5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine?
5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine has a molecular weight of 273.38 g/mol, XLogP of 3.16, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[2-(dimethylamino)phenyl]-3-methyl-1-propan-2-ylpyrazole-4,5-diamine is sourced from PubChem (CID 106759506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).