(2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol

C19H23NO — CID 103788778

IUPAC(2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol
SMILESCC1CCC(N[C@@H](CO)c2ccccc2)c2ccccc21
InChIInChI=1S/C19H23NO/c1-14-11-12-18(17-10-6-5-9-16(14)17)20-19(13-21)15-7-3-2-4-8-15/h2-10,14,18-21H,11-13H2,1H3/t14?,18?,19-/m0/s1
InChIKeyQXNOXIPQMSADSA-FPCQFERPSA-N
MW281.40 g/mol
LogP3.95
Rot. Bonds4

About (2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol

(2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol (PubChem CID 103788778) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is (2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol
PubChem CID103788778
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name(2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol
SMILESCC1CCC(N[C@@H](CO)c2ccccc2)c2ccccc21
InChIInChI=1S/C19H23NO/c1-14-11-12-18(17-10-6-5-9-16(14)17)20-19(13-21)15-7-3-2-4-8-15/h2-10,14,18-21H,11-13H2,1H3/t14?,18?,19-/m0/s1
InChIKeyQXNOXIPQMSADSA-FPCQFERPSA-N
XLogP3.95
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propan-1-ol
CID 103789078
(2R)-2-(3,4-dihydro-2H-chromen-4-ylamino)-2-phenylethanol
CID 103788750
(2R)-2-phenyl-2-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-ylamino)ethanol
CID 107862596
4-methyl-N-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 81301517
2-[(6-methyl-2,3-dihydro-1H-inden-1-yl)amino]-2-phenylethanol
CID 81339043
(2S)-2-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]-2-phenylethanol
CID 103784055
(2S)-2-(cyclopropylamino)-2-phenylethanol
CID 93471499
4-methyl-N-(3-methylbutan-2-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 113305898
N-[(1R)-1-(4-bromophenyl)ethyl]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115418510
4-methyl-N-(1-pyridin-4-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 81301993
N-[(1S)-1-(3-bromophenyl)ethyl]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115418519
N-(3-ethylpentan-2-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115418412

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol?
The IUPAC name of (2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol (CID 103788778) is (2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol.
What is the SMILES notation for (2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol?
The canonical SMILES for (2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol is CC1CCC(N[C@@H](CO)c2ccccc2)c2ccccc21.
What is the InChIKey of (2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol?
The InChIKey is QXNOXIPQMSADSA-FPCQFERPSA-N. The full InChI is InChI=1S/C19H23NO/c1-14-11-12-18(17-10-6-5-9-16(14)17)20-19(13-21)15-7-3-2-4-8-15/h2-10,14,18-21H,11-13H2,1H3/t14?,18?,19-/m0/s1.
What are the key properties of (2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol?
(2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol has a molecular weight of 281.40 g/mol, XLogP of 3.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(4-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-2-phenylethanol is sourced from PubChem (CID 103788778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).