3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine

C13H24N4 — CID 66029836

IUPAC3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine
SMILESCc1nn(C(C)C)c(N2CCCC(C)C2)c1N
InChIInChI=1S/C13H24N4/c1-9(2)17-13(12(14)11(4)15-17)16-7-5-6-10(3)8-16/h9-10H,5-8,14H2,1-4H3
InChIKeyZYKFHUIEYRMGLI-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.59
Rot. Bonds2

About 3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine

3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine (PubChem CID 66029836) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is 3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine.

Molecular Properties

Compound Name3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine
PubChem CID66029836
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine
SMILESCc1nn(C(C)C)c(N2CCCC(C)C2)c1N
InChIInChI=1S/C13H24N4/c1-9(2)17-13(12(14)11(4)15-17)16-7-5-6-10(3)8-16/h9-10H,5-8,14H2,1-4H3
InChIKeyZYKFHUIEYRMGLI-UHFFFAOYSA-N
XLogP2.59
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidine-3-carboxamide
CID 66027903
1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)-N-methylpiperidine-3-carboxamide
CID 103194427
5-(2,6-dimethylmorpholin-4-yl)-3-methyl-1-propan-2-ylpyrazol-4-amine
CID 66029643
5-(2,6-dimethylthiomorpholin-4-yl)-3-methyl-1-propan-2-ylpyrazol-4-amine
CID 66024816
1-[1-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)piperidin-4-yl]ethanol
CID 106835389
5-(2,4-dimethylpiperidin-1-yl)-3-methyl-1-propan-2-ylpyrazol-4-amine
CID 66029130
1,3-dimethyl-5-(3-methylpyrrolidin-1-yl)pyrazol-4-amine
CID 61225576
4-(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)-1,4-diazepan-2-one
CID 66026380
5-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]-3-methyl-1-propan-2-ylpyrazol-4-amine
CID 66029704
5-(4-butan-2-ylpiperazin-1-yl)-3-methyl-1-propan-2-ylpyrazol-4-amine
CID 66027205
[1,3-dimethyl-5-(3-methylpiperidin-1-yl)pyrazol-4-yl]methanamine
CID 43122238
5-(3-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-amine
CID 43584190

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine?
The IUPAC name of 3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine (CID 66029836) is 3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine.
What is the SMILES notation for 3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine?
The canonical SMILES for 3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine is Cc1nn(C(C)C)c(N2CCCC(C)C2)c1N.
What is the InChIKey of 3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine?
The InChIKey is ZYKFHUIEYRMGLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-9(2)17-13(12(14)11(4)15-17)16-7-5-6-10(3)8-16/h9-10H,5-8,14H2,1-4H3.
What are the key properties of 3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine?
3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine has a molecular weight of 236.36 g/mol, XLogP of 2.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(3-methylpiperidin-1-yl)-1-propan-2-ylpyrazol-4-amine is sourced from PubChem (CID 66029836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).