4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine

C12H22N4 — CID 107912156

IUPAC4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine
SMILESCc1cn(CCC2CCCCN2C)nc1N
InChIInChI=1S/C12H22N4/c1-10-9-16(14-12(10)13)8-6-11-5-3-4-7-15(11)2/h9,11H,3-8H2,1-2H3,(H2,13,14)
InChIKeyOJUBMBMAEJIXTC-UHFFFAOYSA-N
MW222.34 g/mol
LogP1.65
Rot. Bonds3

About 4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine

4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine (PubChem CID 107912156) has the molecular formula C12H22N4 and a molecular weight of 222.34 g/mol. Its IUPAC name is 4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine.

Molecular Properties

Compound Name4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine
PubChem CID107912156
Molecular FormulaC12H22N4
Molecular Weight222.34 g/mol
Exact Mass222.18
IUPAC Name4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine
SMILESCc1cn(CCC2CCCCN2C)nc1N
InChIInChI=1S/C12H22N4/c1-10-9-16(14-12(10)13)8-6-11-5-3-4-7-15(11)2/h9,11H,3-8H2,1-2H3,(H2,13,14)
InChIKeyOJUBMBMAEJIXTC-UHFFFAOYSA-N
XLogP1.65
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.34
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(1-methylpiperidin-2-yl)ethyl]-1,2,4-triazole-3-carbonitrile
CID 103607029
[1-[2-(1-methylpiperidin-2-yl)ethyl]imidazol-4-yl]methanamine
CID 107913121
(2R)-2-[2-(4-ethylpyrazol-1-yl)ethyl]-1-methylpiperidine
CID 143916063
2-[1-[2-(1-methylpiperidin-2-yl)ethyl]triazol-4-yl]ethanamine
CID 116642161
1-[(1-methylpiperidin-2-yl)methyl]pyrazol-4-amine
CID 170985114
1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazole-4-carboxylic acid
CID 107912883
3-[1-[2-(1-methylpiperidin-2-yl)ethyl]-1,2,4-triazol-3-yl]aniline
CID 107912171
6-[2-(1-methylpiperidin-2-yl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 19369267
5-amino-1-methyl-3-[2-(1-methylpiperidin-2-yl)ethyl]pyrimidine-2,4-dione
CID 107912148
1-methyl-2-[2-(5-methylpyrazol-1-yl)ethyl]piperidine
CID 107914184
1-(4,4-difluorobutyl)-4-methylpyrazol-3-amine
CID 165480778
2,4-dimethyl-3-[2-(1-methylpiperidin-2-yl)ethoxy]aniline
CID 107910970

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine?
The IUPAC name of 4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine (CID 107912156) is 4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine.
What is the SMILES notation for 4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine?
The canonical SMILES for 4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine is Cc1cn(CCC2CCCCN2C)nc1N.
What is the InChIKey of 4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine?
The InChIKey is OJUBMBMAEJIXTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4/c1-10-9-16(14-12(10)13)8-6-11-5-3-4-7-15(11)2/h9,11H,3-8H2,1-2H3,(H2,13,14).
What are the key properties of 4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine?
4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine has a molecular weight of 222.34 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[2-(1-methylpiperidin-2-yl)ethyl]pyrazol-3-amine is sourced from PubChem (CID 107912156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).