(3-amino-2-phenylnaphthalen-1-yl)methanol

C17H15NO — CID 11807045

IUPAC(3-amino-2-phenylnaphthalen-1-yl)methanol
SMILESNc1cc2ccccc2c(CO)c1-c1ccccc1
InChIInChI=1S/C17H15NO/c18-16-10-13-8-4-5-9-14(13)15(11-19)17(16)12-6-2-1-3-7-12/h1-10,19H,11,18H2
InChIKeyDZUDMRRJILENRU-UHFFFAOYSA-N
MW249.31 g/mol
LogP3.58
Rot. Bonds2

About (3-amino-2-phenylnaphthalen-1-yl)methanol

(3-amino-2-phenylnaphthalen-1-yl)methanol (PubChem CID 11807045) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is (3-amino-2-phenylnaphthalen-1-yl)methanol.

Molecular Properties

Compound Name(3-amino-2-phenylnaphthalen-1-yl)methanol
PubChem CID11807045
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name(3-amino-2-phenylnaphthalen-1-yl)methanol
SMILESNc1cc2ccccc2c(CO)c1-c1ccccc1
InChIInChI=1S/C17H15NO/c18-16-10-13-8-4-5-9-14(13)15(11-19)17(16)12-6-2-1-3-7-12/h1-10,19H,11,18H2
InChIKeyDZUDMRRJILENRU-UHFFFAOYSA-N
XLogP3.58
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 53.58
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

5-phenylnaphthalene-2,3-diamine
CID 70378591
[3-(hydroxymethyl)-1,4-dinaphthalen-1-yl-6,13-diphenyl-5,14-dihydropentacen-2-yl]methanol
CID 101456747
phenanthren-9-amine
CID 13695
1-(2,3-diaminonaphthalen-1-yl)propan-2-one
CID 68769782
1,2-diphenylnaphthalene
CID 11208267
1,2,3,4-tetraphenylanthracen-9-amine
CID 87707890
2-(bromomethyl)-1-[2-(bromomethyl)-3-(4-phenylphenyl)naphthalen-1-yl]-3-(4-phenylphenyl)naphthalene
CID 58898275
(2-bromoanthracen-9-yl)methanol
CID 87382861
7-amino-8-phenylnaphthalen-2-ol
CID 115057649
(1,4-dimethyl-3-phenyltriphenylen-2-yl)methanol
CID 71733889
5-hydrazinyl-2-phenylbenzene-1,3-diamine
CID 163437393
2,3,4,5-tetrakis(hydroxymethyl)-6-phenylphenol
CID 88593001

Frequently Asked Questions

What is the IUPAC name of (3-amino-2-phenylnaphthalen-1-yl)methanol?
The IUPAC name of (3-amino-2-phenylnaphthalen-1-yl)methanol (CID 11807045) is (3-amino-2-phenylnaphthalen-1-yl)methanol.
What is the SMILES notation for (3-amino-2-phenylnaphthalen-1-yl)methanol?
The canonical SMILES for (3-amino-2-phenylnaphthalen-1-yl)methanol is Nc1cc2ccccc2c(CO)c1-c1ccccc1.
What is the InChIKey of (3-amino-2-phenylnaphthalen-1-yl)methanol?
The InChIKey is DZUDMRRJILENRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c18-16-10-13-8-4-5-9-14(13)15(11-19)17(16)12-6-2-1-3-7-12/h1-10,19H,11,18H2.
What are the key properties of (3-amino-2-phenylnaphthalen-1-yl)methanol?
(3-amino-2-phenylnaphthalen-1-yl)methanol has a molecular weight of 249.31 g/mol, XLogP of 3.58, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-2-phenylnaphthalen-1-yl)methanol is sourced from PubChem (CID 11807045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).