(R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol

C19H19NO — CID 100804222

IUPAC(R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol
SMILESCc1cc([C@@H](O)c2c(C)ccc3ccccc23)ccc1N
InChIInChI=1S/C19H19NO/c1-12-7-8-14-5-3-4-6-16(14)18(12)19(21)15-9-10-17(20)13(2)11-15/h3-11,19,21H,20H2,1-2H3/t19-/m1/s1
InChIKeyBTFFIWCRXYBJNG-LJQANCHMSA-N
MW277.37 g/mol
LogP4.12
Rot. Bonds2

About (R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol

(R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol (PubChem CID 100804222) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is (R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol.

Molecular Properties

Compound Name(R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol
PubChem CID100804222
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name(R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol
SMILESCc1cc([C@@H](O)c2c(C)ccc3ccccc23)ccc1N
InChIInChI=1S/C19H19NO/c1-12-7-8-14-5-3-4-6-16(14)18(12)19(21)15-9-10-17(20)13(2)11-15/h3-11,19,21H,20H2,1-2H3/t19-/m1/s1
InChIKeyBTFFIWCRXYBJNG-LJQANCHMSA-N
XLogP4.12
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

(S)-(4-bromophenyl)-(2-methylnaphthalen-1-yl)methanol
CID 99714820
(R)-(4-amino-3-methylphenyl)-(3,4-dimethylphenyl)methanol
CID 100804122
(S)-(3-amino-4-methylphenyl)-naphthalen-1-ylmethanol
CID 100804217
(R)-furan-3-yl-(2-methylnaphthalen-1-yl)methanol
CID 97056042
(5-bromo-2-fluorophenyl)-(2-methylnaphthalen-1-yl)methanol
CID 81431062
ethane;2-methyl-1-propan-2-ylnaphthalene
CID 144871891
(3-amino-4-fluorophenyl)-(2-methoxynaphthalen-1-yl)methanol
CID 118356144
1-(2-methylnaphthalen-1-yl)propan-1-ol
CID 80502673
(4-amino-3-methylphenyl)-(4-propan-2-ylphenyl)methanol
CID 91678464
(2-methylnaphthalen-1-yl)-(1-methylpyrrol-2-yl)methanol
CID 91655781
1-[bromo-(4-methoxyphenyl)methyl]-2-methylnaphthalene
CID 81429056
(2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol
CID 79020949

Frequently Asked Questions

What is the IUPAC name of (R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol?
The IUPAC name of (R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol (CID 100804222) is (R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol.
What is the SMILES notation for (R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol?
The canonical SMILES for (R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol is Cc1cc([C@@H](O)c2c(C)ccc3ccccc23)ccc1N.
What is the InChIKey of (R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol?
The InChIKey is BTFFIWCRXYBJNG-LJQANCHMSA-N. The full InChI is InChI=1S/C19H19NO/c1-12-7-8-14-5-3-4-6-16(14)18(12)19(21)15-9-10-17(20)13(2)11-15/h3-11,19,21H,20H2,1-2H3/t19-/m1/s1.
What are the key properties of (R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol?
(R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol has a molecular weight of 277.37 g/mol, XLogP of 4.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(4-amino-3-methylphenyl)-(2-methylnaphthalen-1-yl)methanol is sourced from PubChem (CID 100804222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).