5-butyl-4-methyl-1H-pyrazol-3-amine

C8H15N3 — CID 10103350

IUPAC5-butyl-4-methyl-1H-pyrazol-3-amine
SMILESCCCCc1[nH]nc(N)c1C
InChIInChI=1S/C8H15N3/c1-3-4-5-7-6(2)8(9)11-10-7/h3-5H2,1-2H3,(H3,9,10,11)
InChIKeyDEXXGUSSMVCRLG-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.64
Rot. Bonds3

About 5-butyl-4-methyl-1H-pyrazol-3-amine

5-butyl-4-methyl-1H-pyrazol-3-amine (PubChem CID 10103350) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 5-butyl-4-methyl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-butyl-4-methyl-1H-pyrazol-3-amine
PubChem CID10103350
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name5-butyl-4-methyl-1H-pyrazol-3-amine
SMILESCCCCc1[nH]nc(N)c1C
InChIInChI=1S/C8H15N3/c1-3-4-5-7-6(2)8(9)11-10-7/h3-5H2,1-2H3,(H3,9,10,11)
InChIKeyDEXXGUSSMVCRLG-UHFFFAOYSA-N
XLogP1.64
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-butyl-4-methyl-1H-pyrazol-3-amine?
The IUPAC name of 5-butyl-4-methyl-1H-pyrazol-3-amine (CID 10103350) is 5-butyl-4-methyl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-butyl-4-methyl-1H-pyrazol-3-amine?
The canonical SMILES for 5-butyl-4-methyl-1H-pyrazol-3-amine is CCCCc1[nH]nc(N)c1C.
What is the InChIKey of 5-butyl-4-methyl-1H-pyrazol-3-amine?
The InChIKey is DEXXGUSSMVCRLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-3-4-5-7-6(2)8(9)11-10-7/h3-5H2,1-2H3,(H3,9,10,11).
What are the key properties of 5-butyl-4-methyl-1H-pyrazol-3-amine?
5-butyl-4-methyl-1H-pyrazol-3-amine has a molecular weight of 153.23 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-4-methyl-1H-pyrazol-3-amine is sourced from PubChem (CID 10103350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).