(2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol

C17H19NO — CID 103788767

IUPAC(2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol
SMILESOC[C@H](NC1Cc2ccccc2C1)c1ccccc1
InChIInChI=1S/C17H19NO/c19-12-17(13-6-2-1-3-7-13)18-16-10-14-8-4-5-9-15(14)11-16/h1-9,16-19H,10-12H2/t17-/m0/s1
InChIKeyZEGPBCDHHWXGTQ-KRWDZBQOSA-N
MW253.35 g/mol
LogP2.48
Rot. Bonds4

About (2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol

(2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol (PubChem CID 103788767) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is (2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol
PubChem CID103788767
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name(2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol
SMILESOC[C@H](NC1Cc2ccccc2C1)c1ccccc1
InChIInChI=1S/C17H19NO/c19-12-17(13-6-2-1-3-7-13)18-16-10-14-8-4-5-9-15(14)11-16/h1-9,16-19H,10-12H2/t17-/m0/s1
InChIKeyZEGPBCDHHWXGTQ-KRWDZBQOSA-N
XLogP2.48
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(cyclopropylamino)-2-phenylethanol
CID 93471499
(2S)-2-[(6-bromo-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-2-phenylethanol
CID 103784050
(2S)-2-phenyl-2-[(4-propan-2-ylcyclohexyl)amino]ethanol
CID 103784113
(2S)-2-[(1,1-dioxothian-4-yl)amino]-2-phenylethanol
CID 114010168
(2S)-2-[(3-aminocyclopentyl)amino]-2-phenylethanol
CID 107862243
(2S)-2-(2,3-dihydro-1H-inden-2-ylamino)-3-phenylpropan-1-ol
CID 102613736
2-(hydroxyamino)-2-phenylethanol
CID 12782000
2-[(3-ethylcyclopentyl)amino]-2-phenylethanol
CID 64500919
2-[(2,2-dimethyl-1,3-dihydroinden-1-yl)amino]-2-phenylethanol
CID 82797031
(2S)-2-(1,4-dioxaspiro[4.5]decan-8-ylamino)-2-phenylethanol
CID 95026932
2-[[3-(4-fluorophenyl)cyclobutyl]amino]-2-phenylethanol
CID 63182164
2-[[3-(4-methylphenyl)cyclobutyl]amino]-2-phenylethanol
CID 63182335

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol?
The IUPAC name of (2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol (CID 103788767) is (2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol.
What is the SMILES notation for (2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol?
The canonical SMILES for (2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol is OC[C@H](NC1Cc2ccccc2C1)c1ccccc1.
What is the InChIKey of (2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol?
The InChIKey is ZEGPBCDHHWXGTQ-KRWDZBQOSA-N. The full InChI is InChI=1S/C17H19NO/c19-12-17(13-6-2-1-3-7-13)18-16-10-14-8-4-5-9-15(14)11-16/h1-9,16-19H,10-12H2/t17-/m0/s1.
What are the key properties of (2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol?
(2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol has a molecular weight of 253.35 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol is sourced from PubChem (CID 103788767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).