3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine

C13H23N3 — CID 103164013

IUPAC3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine
SMILESCC(C)Cc1c(CC2CCC2)nn(C)c1N
InChIInChI=1S/C13H23N3/c1-9(2)7-11-12(8-10-5-4-6-10)15-16(3)13(11)14/h9-10H,4-8,14H2,1-3H3
InChIKeyUHCJCBHSKQQAAR-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.54
Rot. Bonds4

About 3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine

3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine (PubChem CID 103164013) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine.

Molecular Properties

Compound Name3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine
PubChem CID103164013
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine
SMILESCC(C)Cc1c(CC2CCC2)nn(C)c1N
InChIInChI=1S/C13H23N3/c1-9(2)7-11-12(8-10-5-4-6-10)15-16(3)13(11)14/h9-10H,4-8,14H2,1-3H3
InChIKeyUHCJCBHSKQQAAR-UHFFFAOYSA-N
XLogP2.54
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclohexylmethyl)-1-methyl-4-propan-2-ylpyrazol-5-amine
CID 113490620
3-(cyclohexylmethyl)-4-fluoro-1-methylpyrazol-5-amine
CID 165492596
5-[(1-methoxycyclobutyl)methyl]-2-methyl-4-(2-methylpropyl)pyrazol-3-amine
CID 103556821
5-(cyclobutylmethyl)-4-(2-methylpropyl)-1H-pyrazol-3-amine
CID 103164012
5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine
CID 63525726
3-(cyclobutylmethyl)-4-(3-fluorophenyl)-1-methylpyrazol-5-amine
CID 103163980
5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine
CID 66200058
3-(cycloheptylmethyl)-1-methyl-4-pyridin-3-ylpyrazol-5-amine
CID 114458050
4-(cyclobutyloxymethyl)-1,3-dimethylpyrazol-5-amine
CID 62190109
5-cyclobutyl-4-ethyl-2-methylpyrazol-3-amine
CID 43670778
4,5-diethyl-2-methylpyrazol-3-amine;hydrate
CID 47000727
3-(3-ethylthiophen-2-yl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine
CID 79975957

Frequently Asked Questions

What is the IUPAC name of 3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine?
The IUPAC name of 3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine (CID 103164013) is 3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine.
What is the SMILES notation for 3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine?
The canonical SMILES for 3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine is CC(C)Cc1c(CC2CCC2)nn(C)c1N.
What is the InChIKey of 3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine?
The InChIKey is UHCJCBHSKQQAAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-9(2)7-11-12(8-10-5-4-6-10)15-16(3)13(11)14/h9-10H,4-8,14H2,1-3H3.
What are the key properties of 3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine?
3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine has a molecular weight of 221.35 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclobutylmethyl)-1-methyl-4-(2-methylpropyl)pyrazol-5-amine is sourced from PubChem (CID 103164013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).