1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine

C15H21N5 — CID 103077821

IUPAC1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine
SMILESCN1CCN(c2nn(C)cc2N)C(c2ccccc2)C1
InChIInChI=1S/C15H21N5/c1-18-8-9-20(15-13(16)10-19(2)17-15)14(11-18)12-6-4-3-5-7-12/h3-7,10,14H,8-9,11,16H2,1-2H3
InChIKeyLVOAXBUHFCESIJ-UHFFFAOYSA-N
MW271.37 g/mol
LogP1.50
Rot. Bonds2

About 1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine

1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine (PubChem CID 103077821) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine.

Molecular Properties

Compound Name1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine
PubChem CID103077821
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine
SMILESCN1CCN(c2nn(C)cc2N)C(c2ccccc2)C1
InChIInChI=1S/C15H21N5/c1-18-8-9-20(15-13(16)10-19(2)17-15)14(11-18)12-6-4-3-5-7-12/h3-7,10,14H,8-9,11,16H2,1-2H3
InChIKeyLVOAXBUHFCESIJ-UHFFFAOYSA-N
XLogP1.50
TPSA50.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-2-(4-methyl-2-phenylpiperazin-1-yl)pyridin-3-amine
CID 81134069
4-bromo-2-(4-methyl-2-phenylpiperazin-1-yl)aniline
CID 65341789
2-fluoro-6-(4-methyl-2-phenylpiperazin-1-yl)aniline
CID 60783031
2,5-dichloro-4-(4-methyl-2-phenylpiperazin-1-yl)pyrimidine
CID 79639316
1-[3-(chloromethyl)-2-pyridinyl]-4-methyl-2-phenylpiperazine
CID 61257187
1,4-dimethyl-2-phenylpiperazine;hydroiodide
CID 168921950
1-[4-(4-methyl-2-phenylpiperazin-1-yl)phenyl]ethanamine
CID 43823529
[2-(4-methyl-2-phenylpiperazin-1-yl)-3-pyridinyl]methyl acetate
CID 132577925
6-(4-methyl-2-phenylpiperazin-1-yl)tetrazolo[1,5-b]pyridazine
CID 17449591
3-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-1-methylpyrazol-4-amine
CID 103078773
6-(4-methyl-2-phenylpiperazin-1-yl)pyridine-2-carbonitrile
CID 64589848
2-(4-methyl-2-phenylpiperazin-1-yl)-1,3-benzoxazole
CID 141201489

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine?
The IUPAC name of 1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine (CID 103077821) is 1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine.
What is the SMILES notation for 1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine?
The canonical SMILES for 1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine is CN1CCN(c2nn(C)cc2N)C(c2ccccc2)C1.
What is the InChIKey of 1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine?
The InChIKey is LVOAXBUHFCESIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-18-8-9-20(15-13(16)10-19(2)17-15)14(11-18)12-6-4-3-5-7-12/h3-7,10,14H,8-9,11,16H2,1-2H3.
What are the key properties of 1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine?
1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine has a molecular weight of 271.37 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(4-methyl-2-phenylpiperazin-1-yl)pyrazol-4-amine is sourced from PubChem (CID 103077821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).