(2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol

C26H25NO — CID 66808040

IUPAC(2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol
SMILESCc1cccc(C(O)(c2cccc(C)c2)[C@H](N)c2ccc3ccccc3c2)c1
InChIInChI=1S/C26H25NO/c1-18-7-5-11-23(15-18)26(28,24-12-6-8-19(2)16-24)25(27)22-14-13-20-9-3-4-10-21(20)17-22/h3-17,25,28H,27H2,1-2H3/t25-/m1/s1
InChIKeyDRYHTPYNBIQKSW-RUZDIDTESA-N
MW367.49 g/mol
LogP5.39
Rot. Bonds4

About (2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol

(2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol (PubChem CID 66808040) has the molecular formula C26H25NO and a molecular weight of 367.49 g/mol. Its IUPAC name is (2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol.

Molecular Properties

Compound Name(2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol
PubChem CID66808040
Molecular FormulaC26H25NO
Molecular Weight367.49 g/mol
Exact Mass367.19
IUPAC Name(2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol
SMILESCc1cccc(C(O)(c2cccc(C)c2)[C@H](N)c2ccc3ccccc3c2)c1
InChIInChI=1S/C26H25NO/c1-18-7-5-11-23(15-18)26(28,24-12-6-8-19(2)16-24)25(27)22-14-13-20-9-3-4-10-21(20)17-22/h3-17,25,28H,27H2,1-2H3/t25-/m1/s1
InChIKeyDRYHTPYNBIQKSW-RUZDIDTESA-N
XLogP5.39
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.49
LogP ≤ 55.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-1,1-bis(3-methoxyphenyl)-2-naphthalen-2-ylethanol
CID 66807936
2-amino-1,1-bis(4-methoxyphenyl)-2-naphthalen-2-ylethanol
CID 23091475
(2R)-2-amino-1,1-bis(2-methoxyphenyl)-2-naphthalen-2-ylethanol
CID 66807925
1,1-bis(3-methylphenyl)-2,2-diphenylethane-1,2-diol
CID 18615291
3-amino-2,2-dimethyl-3-(6-methylnaphthalen-2-yl)propanoic acid
CID 116937993
(1R)-1-amino-3-(4-methoxyphenyl)-2-[(4-methoxyphenyl)methyl]-1-naphthalen-2-ylpropan-2-ol
CID 66807993
2-methoxy-2-methyl-1-naphthalen-2-ylpropan-1-amine
CID 79197880
ethyl (3R)-3-amino-2,2-difluoro-3-naphthalen-2-ylpropanoate;hydrochloride
CID 171240057
3-(3-methylphenyl)-1-naphthalen-2-ylpropan-1-amine
CID 105141723
2-(3-methylphenoxy)-1-naphthalen-2-ylethanamine
CID 43093388
(1S)-2,2,3,3,3-pentafluoro-1-naphthalen-2-ylpropan-1-amine
CID 171311499
amino(naphthalen-2-yl)methanol
CID 57110079

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol?
The IUPAC name of (2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol (CID 66808040) is (2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol.
What is the SMILES notation for (2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol?
The canonical SMILES for (2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol is Cc1cccc(C(O)(c2cccc(C)c2)[C@H](N)c2ccc3ccccc3c2)c1.
What is the InChIKey of (2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol?
The InChIKey is DRYHTPYNBIQKSW-RUZDIDTESA-N. The full InChI is InChI=1S/C26H25NO/c1-18-7-5-11-23(15-18)26(28,24-12-6-8-19(2)16-24)25(27)22-14-13-20-9-3-4-10-21(20)17-22/h3-17,25,28H,27H2,1-2H3/t25-/m1/s1.
What are the key properties of (2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol?
(2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol has a molecular weight of 367.49 g/mol, XLogP of 5.39, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-1,1-bis(3-methylphenyl)-2-naphthalen-2-ylethanol is sourced from PubChem (CID 66808040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).