2-phenyl-1-pyridin-4-ylpropan-1-amine

C14H16N2 — CID 22301590

IUPAC2-phenyl-1-pyridin-4-ylpropan-1-amine
SMILESCC(c1ccccc1)C(N)c1ccncc1
InChIInChI=1S/C14H16N2/c1-11(12-5-3-2-4-6-12)14(15)13-7-9-16-10-8-13/h2-11,14H,15H2,1H3
InChIKeySVUBLCPAWBLKFM-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.89
Rot. Bonds3

About 2-phenyl-1-pyridin-4-ylpropan-1-amine

2-phenyl-1-pyridin-4-ylpropan-1-amine (PubChem CID 22301590) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 2-phenyl-1-pyridin-4-ylpropan-1-amine.

Molecular Properties

Compound Name2-phenyl-1-pyridin-4-ylpropan-1-amine
PubChem CID22301590
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name2-phenyl-1-pyridin-4-ylpropan-1-amine
SMILESCC(c1ccccc1)C(N)c1ccncc1
InChIInChI=1S/C14H16N2/c1-11(12-5-3-2-4-6-12)14(15)13-7-9-16-10-8-13/h2-11,14H,15H2,1H3
InChIKeySVUBLCPAWBLKFM-UHFFFAOYSA-N
XLogP2.89
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-pyridin-4-ylpropan-1-amine?
The IUPAC name of 2-phenyl-1-pyridin-4-ylpropan-1-amine (CID 22301590) is 2-phenyl-1-pyridin-4-ylpropan-1-amine.
What is the SMILES notation for 2-phenyl-1-pyridin-4-ylpropan-1-amine?
The canonical SMILES for 2-phenyl-1-pyridin-4-ylpropan-1-amine is CC(c1ccccc1)C(N)c1ccncc1.
What is the InChIKey of 2-phenyl-1-pyridin-4-ylpropan-1-amine?
The InChIKey is SVUBLCPAWBLKFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-11(12-5-3-2-4-6-12)14(15)13-7-9-16-10-8-13/h2-11,14H,15H2,1H3.
What are the key properties of 2-phenyl-1-pyridin-4-ylpropan-1-amine?
2-phenyl-1-pyridin-4-ylpropan-1-amine has a molecular weight of 212.30 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-pyridin-4-ylpropan-1-amine is sourced from PubChem (CID 22301590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).