3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine

C19H25N3 — CID 140972357

IUPAC3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine
SMILESNCCCN1CCN(c2ccccc2-c2ccccc2)CC1
InChIInChI=1S/C19H25N3/c20-11-6-12-21-13-15-22(16-14-21)19-10-5-4-9-18(19)17-7-2-1-3-8-17/h1-5,7-10H,6,11-16,20H2
InChIKeyFUBDQMZTVURSMF-UHFFFAOYSA-N
MW295.43 g/mol
LogP2.82
Rot. Bonds5

About 3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine

3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine (PubChem CID 140972357) has the molecular formula C19H25N3 and a molecular weight of 295.43 g/mol. Its IUPAC name is 3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine.

Molecular Properties

Compound Name3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine
PubChem CID140972357
Molecular FormulaC19H25N3
Molecular Weight295.43 g/mol
Exact Mass295.20
IUPAC Name3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine
SMILESNCCCN1CCN(c2ccccc2-c2ccccc2)CC1
InChIInChI=1S/C19H25N3/c20-11-6-12-21-13-15-22(16-14-21)19-10-5-4-9-18(19)17-7-2-1-3-8-17/h1-5,7-10H,6,11-16,20H2
InChIKeyFUBDQMZTVURSMF-UHFFFAOYSA-N
XLogP2.82
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-(2-phenoxyphenyl)piperazin-1-yl]propan-1-amine
CID 21136388
3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-amine
CID 10467259
6-[4-(2-fluorophenyl)piperazin-1-yl]hexan-1-amine
CID 60918157
3-[4-(2-methylsulfonylphenyl)piperazin-1-yl]propan-1-amine
CID 60871423
2-amino-1-[4-(2-phenylphenyl)piperazin-1-yl]ethanone
CID 59564588
3-[4-(6-phenylpyrimidin-4-yl)piperazin-1-yl]propan-1-amine
CID 82166145
3-[4-[2-(cyclopropylmethoxy)phenyl]piperazin-1-yl]propan-1-amine
CID 21473467
N'-[3-[4-(2-methylphenyl)piperazin-1-yl]propyl]ethane-1,2-diamine
CID 10492743
6-[4-[2-(trifluoromethyl)phenyl]piperazin-1-yl]hexan-1-amine
CID 139693229
3-[4-(2-methylsulfonylphenyl)-1,4-diazepan-1-yl]propan-1-amine
CID 60869877
4-[4-[2-(2-fluoroethoxy)phenyl]piperazin-1-yl]butan-1-amine
CID 51357649
3-(4-pyridin-2-ylpiperazin-1-yl)propan-1-amine
CID 14854856

Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine?
The IUPAC name of 3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine (CID 140972357) is 3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine.
What is the SMILES notation for 3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine?
The canonical SMILES for 3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine is NCCCN1CCN(c2ccccc2-c2ccccc2)CC1.
What is the InChIKey of 3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine?
The InChIKey is FUBDQMZTVURSMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3/c20-11-6-12-21-13-15-22(16-14-21)19-10-5-4-9-18(19)17-7-2-1-3-8-17/h1-5,7-10H,6,11-16,20H2.
What are the key properties of 3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine?
3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine has a molecular weight of 295.43 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-phenylphenyl)piperazin-1-yl]propan-1-amine is sourced from PubChem (CID 140972357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).