1-butan-2-yl-5-methylpyrazol-3-amine

C8H15N3 — CID 19619852

IUPAC1-butan-2-yl-5-methylpyrazol-3-amine
SMILESCCC(C)n1nc(N)cc1C
InChIInChI=1S/C8H15N3/c1-4-6(2)11-7(3)5-8(9)10-11/h5-6H,4H2,1-3H3,(H2,9,10)
InChIKeyJAECFTRSRXBSGJ-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.74
Rot. Bonds2

About 1-butan-2-yl-5-methylpyrazol-3-amine

1-butan-2-yl-5-methylpyrazol-3-amine (PubChem CID 19619852) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 1-butan-2-yl-5-methylpyrazol-3-amine.

Molecular Properties

Compound Name1-butan-2-yl-5-methylpyrazol-3-amine
PubChem CID19619852
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name1-butan-2-yl-5-methylpyrazol-3-amine
SMILESCCC(C)n1nc(N)cc1C
InChIInChI=1S/C8H15N3/c1-4-6(2)11-7(3)5-8(9)10-11/h5-6H,4H2,1-3H3,(H2,9,10)
InChIKeyJAECFTRSRXBSGJ-UHFFFAOYSA-N
XLogP1.74
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-butan-2-yl-5-methylpyrazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,3-Dimethyl-1H-pyrazol-5-amine
CID 520721
1-Isopropyl-3-methyl-1H-pyrazol-5-amine
CID 121018
1-tert-Butyl-3-methyl-1H-pyrazol-5-amine
CID 737200
1-Ethyl-3-methyl-1H-pyrazol-5-amine
CID 2768383
2-(5-Amino-3-methyl-1H-pyrazol-1-yl)ethan-1-ol
CID 5018373
3-methyl-1-pentyl-1H-pyrazol-5-amine
CID 2828712
(E)-3-(5-amino-3-methylpyrazol-1-yl)but-2-enenitrile
CID 854933
5-Methyl-2-(1-methyl-piperidin-4-yl)-2H-pyrazol-3-ylamine
CID 646883
Guanidine, 1-tert-butyl-2-cyano-3-(1-ethyl-3-methyl-5-pyrazolyl)-
CID 3050769
1,5-dimethyl-1H-pyrazol-3-amine
CID 7017747
1-Cyclopentyl-3-methyl-1H-pyrazol-5-amine
CID 3152524
1-Cyclohexyl-3-methyl-1H-pyrazol-5-amine
CID 4571951

Frequently Asked Questions

What is the IUPAC name of 1-butan-2-yl-5-methylpyrazol-3-amine?
The IUPAC name of 1-butan-2-yl-5-methylpyrazol-3-amine (CID 19619852) is 1-butan-2-yl-5-methylpyrazol-3-amine.
What is the SMILES notation for 1-butan-2-yl-5-methylpyrazol-3-amine?
The canonical SMILES for 1-butan-2-yl-5-methylpyrazol-3-amine is CCC(C)n1nc(N)cc1C.
What is the InChIKey of 1-butan-2-yl-5-methylpyrazol-3-amine?
The InChIKey is JAECFTRSRXBSGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-4-6(2)11-7(3)5-8(9)10-11/h5-6H,4H2,1-3H3,(H2,9,10).
What are the key properties of 1-butan-2-yl-5-methylpyrazol-3-amine?
1-butan-2-yl-5-methylpyrazol-3-amine has a molecular weight of 153.23 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-5-methylpyrazol-3-amine is sourced from PubChem (CID 19619852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).