(1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine

C18H29N — CID 59843953

IUPAC(1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine
SMILESC[C@H](C1CCCC1C(C)(C)c1ccccc1)N(C)C
InChIInChI=1S/C18H29N/c1-14(19(4)5)16-12-9-13-17(16)18(2,3)15-10-7-6-8-11-15/h6-8,10-11,14,16-17H,9,12-13H2,1-5H3/t14-,16?,17?/m1/s1
InChIKeyJBXYAACIGQFOFV-ODIFPOPNSA-N
MW259.44 g/mol
LogP4.33
Rot. Bonds4

About (1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine

(1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine (PubChem CID 59843953) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is (1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine.

Molecular Properties

Compound Name(1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine
PubChem CID59843953
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC Name(1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine
SMILESC[C@H](C1CCCC1C(C)(C)c1ccccc1)N(C)C
InChIInChI=1S/C18H29N/c1-14(19(4)5)16-12-9-13-17(16)18(2,3)15-10-7-6-8-11-15/h6-8,10-11,14,16-17H,9,12-13H2,1-5H3/t14-,16?,17?/m1/s1
InChIKeyJBXYAACIGQFOFV-ODIFPOPNSA-N
XLogP4.33
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-dimethyl-1-(2-phenylcyclohexyl)ethanamine
CID 70492247
cyclopentane;[2-[(1R)-1-(dimethylamino)ethyl]cyclopentyl]-dimethyl-phenylphosphanium
CID 90743045
(1R)-1-[2-[chloro(phenyl)phosphanyl]cyclopentyl]-N,N-dimethylethanamine
CID 58470969
CID 58921842
CID 58921842
carbanide;cyclopentane;(1S)-1-(2-diphenylphosphanylcyclopentyl)-N,N-dimethylethanamine;iron(2+)
CID 155882684
(1S)-1-(2-diphenylphosphanyl-3-methylcyclohexyl)-N,N-dimethylethanamine
CID 59690756
cyclopentane;1-(2-diphenylphosphanylcyclopentyl)-N,N-dimethylethanamine;iron;hydrate
CID 171371546
(1R)-1-[2,3-bis(diphenylphosphanyl)cyclopentyl]-N,N-dimethylethanamine;carbanide;cyclopentane;iron(2+)
CID 162295201
carbanide;bis(cyclopentane);bis((1R)-1-[2-[cyclopentyl(phenyl)phosphanyl]cyclopentyl]-N,N-dimethylethanamine);tris(iron(2+))
CID 162295221
(1S,2R,5S)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexan-1-ol
CID 12860618
(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexan-1-ol;hydrate
CID 174940939
1-[2-(1-diphenylphosphanylethyl)cyclopentyl]ethyl-diphenylphosphane
CID 23403232

Frequently Asked Questions

What is the IUPAC name of (1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine?
The IUPAC name of (1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine (CID 59843953) is (1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine.
What is the SMILES notation for (1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine?
The canonical SMILES for (1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine is C[C@H](C1CCCC1C(C)(C)c1ccccc1)N(C)C.
What is the InChIKey of (1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine?
The InChIKey is JBXYAACIGQFOFV-ODIFPOPNSA-N. The full InChI is InChI=1S/C18H29N/c1-14(19(4)5)16-12-9-13-17(16)18(2,3)15-10-7-6-8-11-15/h6-8,10-11,14,16-17H,9,12-13H2,1-5H3/t14-,16?,17?/m1/s1.
What are the key properties of (1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine?
(1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine has a molecular weight of 259.44 g/mol, XLogP of 4.33, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N,N-dimethyl-1-[2-(2-phenylpropan-2-yl)cyclopentyl]ethanamine is sourced from PubChem (CID 59843953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).