4-propyl-1H-pyrazol-5-amine

C6H11N3 — CID 19002212

IUPAC4-propyl-1H-pyrazol-5-amine
SMILESCCCc1cn[nH]c1N
InChIInChI=1S/C6H11N3/c1-2-3-5-4-8-9-6(5)7/h4H,2-3H2,1H3,(H3,7,8,9)
InChIKeyPLIAITMRGNSLTO-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.94
Rot. Bonds2

About 4-propyl-1H-pyrazol-5-amine

4-propyl-1H-pyrazol-5-amine (PubChem CID 19002212) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 4-propyl-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-propyl-1H-pyrazol-5-amine
PubChem CID19002212
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name4-propyl-1H-pyrazol-5-amine
SMILESCCCc1cn[nH]c1N
InChIInChI=1S/C6H11N3/c1-2-3-5-4-8-9-6(5)7/h4H,2-3H2,1H3,(H3,7,8,9)
InChIKeyPLIAITMRGNSLTO-UHFFFAOYSA-N
XLogP0.94
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-propyl-1H-pyrazole
CID 12943708
1H-Pyrazole-4-propanamine
CID 152327
4-Methyl-1H-pyrazol-3-amine
CID 12383043
4-Ethyl-1H-pyrazol-3-amine
CID 11789157
4-(1-Methylpropyl)-1H-pyrazole
CID 14746485
4-Isopropyl-1H-pyrazol-3-amine
CID 19002201
4-cyclopropyl-1H-pyrazol-3-amine
CID 23569310
4-(2-methylpropyl)-1H-pyrazole
CID 58592546
4-cyclobutyl-1H-pyrazol-5-amine
CID 86276778
3-(5-amino-1H-pyrazol-4-yl)propan-1-ol
CID 50989647
4-(2-methylpropyl)-1H-pyrazol-5-amine
CID 61647149
2-methyl-3-(1H-pyrazol-4-yl)propan-1-amine
CID 83872314

Frequently Asked Questions

What is the IUPAC name of 4-propyl-1H-pyrazol-5-amine?
The IUPAC name of 4-propyl-1H-pyrazol-5-amine (CID 19002212) is 4-propyl-1H-pyrazol-5-amine.
What is the SMILES notation for 4-propyl-1H-pyrazol-5-amine?
The canonical SMILES for 4-propyl-1H-pyrazol-5-amine is CCCc1cn[nH]c1N.
What is the InChIKey of 4-propyl-1H-pyrazol-5-amine?
The InChIKey is PLIAITMRGNSLTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-2-3-5-4-8-9-6(5)7/h4H,2-3H2,1H3,(H3,7,8,9).
What are the key properties of 4-propyl-1H-pyrazol-5-amine?
4-propyl-1H-pyrazol-5-amine has a molecular weight of 125.17 g/mol, XLogP of 0.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propyl-1H-pyrazol-5-amine is sourced from PubChem (CID 19002212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).