2-(2-phenylpyrazol-3-yl)propan-1-amine

C12H15N3 — CID 105453704

IUPAC2-(2-phenylpyrazol-3-yl)propan-1-amine
SMILESCC(CN)c1ccnn1-c1ccccc1
InChIInChI=1S/C12H15N3/c1-10(9-13)12-7-8-14-15(12)11-5-3-2-4-6-11/h2-8,10H,9,13H2,1H3
InChIKeyLUZXQHVPILIGNS-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.93
Rot. Bonds3

About 2-(2-phenylpyrazol-3-yl)propan-1-amine

2-(2-phenylpyrazol-3-yl)propan-1-amine (PubChem CID 105453704) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-(2-phenylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name2-(2-phenylpyrazol-3-yl)propan-1-amine
PubChem CID105453704
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name2-(2-phenylpyrazol-3-yl)propan-1-amine
SMILESCC(CN)c1ccnn1-c1ccccc1
InChIInChI=1S/C12H15N3/c1-10(9-13)12-7-8-14-15(12)11-5-3-2-4-6-11/h2-8,10H,9,13H2,1H3
InChIKeyLUZXQHVPILIGNS-UHFFFAOYSA-N
XLogP1.93
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-3-(2-phenylpyrazol-3-yl)butan-1-amine
CID 107331506
3-amino-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one
CID 107331628
2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butan-1-ol
CID 107332293
N,2-dimethyl-1-(2-phenylpyrazol-3-yl)propan-1-amine
CID 107330520
[2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butyl]hydrazine
CID 107332493
2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine
CID 107331496
4-methoxy-3-methyl-1-(2-phenylpyrazol-3-yl)butan-1-amine
CID 107332084
(5-ethylthiophen-2-yl)-(2-phenylpyrazol-3-yl)methanamine
CID 107331981
2-[2-(2-methylpropyl)pyrazol-3-yl]propan-1-amine
CID 83875873
2-[4-(5-methylpyrazol-1-yl)phenyl]propan-1-amine
CID 117307089
N-ethyl-3-methyl-1-(2-phenylpyrazol-3-yl)butan-1-amine
CID 107330516
(5-methylthiophen-2-yl)-(2-phenylpyrazol-3-yl)methanamine
CID 107332136

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylpyrazol-3-yl)propan-1-amine?
The IUPAC name of 2-(2-phenylpyrazol-3-yl)propan-1-amine (CID 105453704) is 2-(2-phenylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for 2-(2-phenylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for 2-(2-phenylpyrazol-3-yl)propan-1-amine is CC(CN)c1ccnn1-c1ccccc1.
What is the InChIKey of 2-(2-phenylpyrazol-3-yl)propan-1-amine?
The InChIKey is LUZXQHVPILIGNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-10(9-13)12-7-8-14-15(12)11-5-3-2-4-6-11/h2-8,10H,9,13H2,1H3.
What are the key properties of 2-(2-phenylpyrazol-3-yl)propan-1-amine?
2-(2-phenylpyrazol-3-yl)propan-1-amine has a molecular weight of 201.27 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 105453704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).