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

C18H19N3 — CID 107331496

IUPAC2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine
SMILESNCC(Cc1ccnn1-c1ccccc1)c1ccccc1
InChIInChI=1S/C18H19N3/c19-14-16(15-7-3-1-4-8-15)13-18-11-12-20-21(18)17-9-5-2-6-10-17/h1-12,16H,13-14,19H2
InChIKeyDJPYZDFWZHGIKW-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.16
Rot. Bonds5

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

2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine (PubChem CID 107331496) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine
PubChem CID107331496
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine
SMILESNCC(Cc1ccnn1-c1ccccc1)c1ccccc1
InChIInChI=1S/C18H19N3/c19-14-16(15-7-3-1-4-8-15)13-18-11-12-20-21(18)17-9-5-2-6-10-17/h1-12,16H,13-14,19H2
InChIKeyDJPYZDFWZHGIKW-UHFFFAOYSA-N
XLogP3.16
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine?
The IUPAC name of 2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine (CID 107331496) is 2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for 2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for 2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine is NCC(Cc1ccnn1-c1ccccc1)c1ccccc1.
What is the InChIKey of 2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine?
The InChIKey is DJPYZDFWZHGIKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c19-14-16(15-7-3-1-4-8-15)13-18-11-12-20-21(18)17-9-5-2-6-10-17/h1-12,16H,13-14,19H2.
What are the key properties of 2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine?
2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine has a molecular weight of 277.37 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3-(2-phenylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 107331496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).