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

C17H18N2 — CID 154276065

IUPAC1-(3-phenylindol-1-yl)propan-2-amine
SMILESCC(N)Cn1cc(-c2ccccc2)c2ccccc21
InChIInChI=1S/C17H18N2/c1-13(18)11-19-12-16(14-7-3-2-4-8-14)15-9-5-6-10-17(15)19/h2-10,12-13H,11,18H2,1H3
InChIKeyHPOFFVSQUVOVLB-UHFFFAOYSA-N
MW250.35 g/mol
LogP3.66
Rot. Bonds3

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

1-(3-phenylindol-1-yl)propan-2-amine (PubChem CID 154276065) has the molecular formula C17H18N2 and a molecular weight of 250.35 g/mol. Its IUPAC name is 1-(3-phenylindol-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-(3-phenylindol-1-yl)propan-2-amine
PubChem CID154276065
Molecular FormulaC17H18N2
Molecular Weight250.35 g/mol
Exact Mass250.15
IUPAC Name1-(3-phenylindol-1-yl)propan-2-amine
SMILESCC(N)Cn1cc(-c2ccccc2)c2ccccc21
InChIInChI=1S/C17H18N2/c1-13(18)11-19-12-16(14-7-3-2-4-8-14)15-9-5-6-10-17(15)19/h2-10,12-13H,11,18H2,1H3
InChIKeyHPOFFVSQUVOVLB-UHFFFAOYSA-N
XLogP3.66
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(methylamino)-3-(3-phenylindol-1-yl)propan-2-ol
CID 91261190
3-(3-phenylindol-1-yl)propan-1-amine
CID 15134122
[4-[1-(2-methylpropyl)-6-phenylindol-3-yl]phenyl]methanamine
CID 166911633
1-carbazol-9-ylpropan-2-amine
CID 21430322
3-phenyl-1-[2-[(E)-prop-1-enoxy]ethyl]indole
CID 134842217
(2S)-3-methyl-1-(3-methylindol-1-yl)butan-2-amine
CID 59622325
1-(2-iodophenyl)-2-(3-phenylindol-1-yl)ethanone
CID 146509223
1-[1-(2-phenylethyl)indol-3-yl]propan-2-amine
CID 66404648
1-indol-1-ylpropan-2-amine
CID 20806570
2-[3-(dimethylamino)-2-methylpropyl]-4-phenylisoquinolin-1-one
CID 12812996
1-(1-benzylindol-3-yl)propan-2-amine
CID 3137663
ethyl 3-phenylindole-1-carboxylate
CID 69433290

Frequently Asked Questions

What is the IUPAC name of 1-(3-phenylindol-1-yl)propan-2-amine?
The IUPAC name of 1-(3-phenylindol-1-yl)propan-2-amine (CID 154276065) is 1-(3-phenylindol-1-yl)propan-2-amine.
What is the SMILES notation for 1-(3-phenylindol-1-yl)propan-2-amine?
The canonical SMILES for 1-(3-phenylindol-1-yl)propan-2-amine is CC(N)Cn1cc(-c2ccccc2)c2ccccc21.
What is the InChIKey of 1-(3-phenylindol-1-yl)propan-2-amine?
The InChIKey is HPOFFVSQUVOVLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2/c1-13(18)11-19-12-16(14-7-3-2-4-8-14)15-9-5-6-10-17(15)19/h2-10,12-13H,11,18H2,1H3.
What are the key properties of 1-(3-phenylindol-1-yl)propan-2-amine?
1-(3-phenylindol-1-yl)propan-2-amine has a molecular weight of 250.35 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-phenylindol-1-yl)propan-2-amine is sourced from PubChem (CID 154276065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).