2-phenylbicyclo[3.3.1]nonan-9-amine

C15H21N — CID 19875091

IUPAC2-phenylbicyclo[3.3.1]nonan-9-amine
SMILESNC1C2CCCC1C(c1ccccc1)CC2
InChIInChI=1S/C15H21N/c16-15-12-7-4-8-14(15)13(10-9-12)11-5-2-1-3-6-11/h1-3,5-6,12-15H,4,7-10,16H2
InChIKeyPHUJWIGMVHODPM-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.31
Rot. Bonds1

About 2-phenylbicyclo[3.3.1]nonan-9-amine

2-phenylbicyclo[3.3.1]nonan-9-amine (PubChem CID 19875091) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-phenylbicyclo[3.3.1]nonan-9-amine.

Molecular Properties

Compound Name2-phenylbicyclo[3.3.1]nonan-9-amine
PubChem CID19875091
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name2-phenylbicyclo[3.3.1]nonan-9-amine
SMILESNC1C2CCCC1C(c1ccccc1)CC2
InChIInChI=1S/C15H21N/c16-15-12-7-4-8-14(15)13(10-9-12)11-5-2-1-3-6-11/h1-3,5-6,12-15H,4,7-10,16H2
InChIKeyPHUJWIGMVHODPM-UHFFFAOYSA-N
XLogP3.31
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-phenyl-1,2,3,3a,4,5,6,6a-octahydropentalen-1-amine
CID 167142843
chlororuthenium;1-phenyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indene;bis(triphenylphosphane)
CID 171369681
(7aS)-2-methyl-4-phenyl-1,3,3a,4,5,6,7,7a-octahydroisoindole
CID 67618847
trans-(1S,2R)-2-phenylcyclohexan-1-amine;hydrochloride
CID 21128019
(1S,4aR,8R,8aR)-8-phenyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ol
CID 10609515
dimethyl-bis(4-phenyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-1-yl)silane
CID 165155308
(1S,2R,3R,4R)-3-phenylbicyclo[2.2.1]heptan-2-amine
CID 13405457
(3aS,7R,7aS)-7-phenyl-3a,4,5,6,7,7a-hexahydro-3H-2-benzofuran-1-one
CID 10560670
(1R,2R,3R,6S)-3,6-diphenylcyclohexane-1,2-diol
CID 98598015
cis-(1R,2R)-2-phenylcyclopropan-1-amine;cis-(1S,2S)-2-phenylcyclopropan-1-amine;dihydrochloride
CID 76967138
(1R,2R,3S,6S)-3,6-diphenylcyclohexane-1,2-diol
CID 124792855
9,10-diphenyl-1,2,3,4,4a,5,6,7,8,8a,9,9a,10,10a-tetradecahydroanthracene
CID 140505234

Frequently Asked Questions

What is the IUPAC name of 2-phenylbicyclo[3.3.1]nonan-9-amine?
The IUPAC name of 2-phenylbicyclo[3.3.1]nonan-9-amine (CID 19875091) is 2-phenylbicyclo[3.3.1]nonan-9-amine.
What is the SMILES notation for 2-phenylbicyclo[3.3.1]nonan-9-amine?
The canonical SMILES for 2-phenylbicyclo[3.3.1]nonan-9-amine is NC1C2CCCC1C(c1ccccc1)CC2.
What is the InChIKey of 2-phenylbicyclo[3.3.1]nonan-9-amine?
The InChIKey is PHUJWIGMVHODPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c16-15-12-7-4-8-14(15)13(10-9-12)11-5-2-1-3-6-11/h1-3,5-6,12-15H,4,7-10,16H2.
What are the key properties of 2-phenylbicyclo[3.3.1]nonan-9-amine?
2-phenylbicyclo[3.3.1]nonan-9-amine has a molecular weight of 215.34 g/mol, XLogP of 3.31, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylbicyclo[3.3.1]nonan-9-amine is sourced from PubChem (CID 19875091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).