1-pyrazol-1-ylpropan-2-amine

C6H11N3 — CID 6483888

IUPAC1-pyrazol-1-ylpropan-2-amine
SMILESCC(N)Cn1cccn1
InChIInChI=1S/C6H11N3/c1-6(7)5-9-4-2-3-8-9/h2-4,6H,5,7H2,1H3
InChIKeyUWVUXGHAXNILPG-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.23
Rot. Bonds2

About 1-pyrazol-1-ylpropan-2-amine

1-pyrazol-1-ylpropan-2-amine (PubChem CID 6483888) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 1-pyrazol-1-ylpropan-2-amine.

Molecular Properties

Compound Name1-pyrazol-1-ylpropan-2-amine
PubChem CID6483888
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name1-pyrazol-1-ylpropan-2-amine
SMILESCC(N)Cn1cccn1
InChIInChI=1S/C6H11N3/c1-6(7)5-9-4-2-3-8-9/h2-4,6H,5,7H2,1H3
InChIKeyUWVUXGHAXNILPG-UHFFFAOYSA-N
XLogP0.23
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-1H-pyrazol-4-amine
CID 4770990
1H-Pyrazole, 1-methyl-
CID 70255
1-Ethylpyrazole
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1-cyclopentyl-1H-pyrazole
CID 10844435
1-tert-Butyl-1H-pyrazole
CID 13469815
2-(1H-pyrazol-1-yl)ethan-1-amine
CID 1133022
4-(1H-Pyrazol-1-yl)piperidine
CID 21193045
1-(prop-2-en-1-yl)-1H-pyrazole
CID 3489293
1-ethenyl-1H-pyrazole
CID 6420997
1-Propyl-1H-pyrazole
CID 12711096
1-isopropyl-1H-pyrazole
CID 13469816
3-(1H-pyrazol-1-yl)piperidine
CID 47003266

Frequently Asked Questions

What is the IUPAC name of 1-pyrazol-1-ylpropan-2-amine?
The IUPAC name of 1-pyrazol-1-ylpropan-2-amine (CID 6483888) is 1-pyrazol-1-ylpropan-2-amine.
What is the SMILES notation for 1-pyrazol-1-ylpropan-2-amine?
The canonical SMILES for 1-pyrazol-1-ylpropan-2-amine is CC(N)Cn1cccn1.
What is the InChIKey of 1-pyrazol-1-ylpropan-2-amine?
The InChIKey is UWVUXGHAXNILPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-6(7)5-9-4-2-3-8-9/h2-4,6H,5,7H2,1H3.
What are the key properties of 1-pyrazol-1-ylpropan-2-amine?
1-pyrazol-1-ylpropan-2-amine has a molecular weight of 125.17 g/mol, XLogP of 0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazol-1-ylpropan-2-amine is sourced from PubChem (CID 6483888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).