1-[(R)-amino(phenyl)methyl]naphthalen-2-ol

C17H15NO — CID 6935961

IUPAC1-[(R)-amino(phenyl)methyl]naphthalen-2-ol
SMILESN[C@H](c1ccccc1)c1c(O)ccc2ccccc12
InChIInChI=1S/C17H15NO/c18-17(13-7-2-1-3-8-13)16-14-9-5-4-6-12(14)10-11-15(16)19/h1-11,17,19H,18H2/t17-/m1/s1
InChIKeyPZMIGEOOGFFCNT-QGZVFWFLSA-N
MW249.31 g/mol
LogP3.59
Rot. Bonds2

About 1-[(R)-amino(phenyl)methyl]naphthalen-2-ol

1-[(R)-amino(phenyl)methyl]naphthalen-2-ol (PubChem CID 6935961) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is 1-[(R)-amino(phenyl)methyl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[(R)-amino(phenyl)methyl]naphthalen-2-ol
PubChem CID6935961
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name1-[(R)-amino(phenyl)methyl]naphthalen-2-ol
SMILESN[C@H](c1ccccc1)c1c(O)ccc2ccccc12
InChIInChI=1S/C17H15NO/c18-17(13-7-2-1-3-8-13)16-14-9-5-4-6-12(14)10-11-15(16)19/h1-11,17,19H,18H2/t17-/m1/s1
InChIKeyPZMIGEOOGFFCNT-QGZVFWFLSA-N
XLogP3.59
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 ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

1-[(R)-amino-(4-bromophenyl)methyl]naphthalen-2-ol
CID 39345448
1-[(R)-amino-(3-bromophenyl)methyl]naphthalen-2-ol
CID 39345444
1-(1-amino-2-hydroxyethyl)naphthalen-2-ol
CID 77129792
1-[(R)-amino(thiophen-2-yl)methyl]naphthalen-2-ol
CID 171232072
1-[(1S)-1-aminopropyl]naphthalen-2-ol
CID 93030603
1-[(1R)-1,2-diaminoethyl]naphthalen-2-ol;hydrochloride
CID 171232039
1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol
CID 39345560
1-(1-amino-3-hydroxypropyl)naphthalen-2-ol;hydrochloride
CID 170874425
3-amino-3-(2-hydroxynaphthalen-1-yl)propanamide
CID 170875681
1-[(1R,2S)-1-amino-2-hydroxypropyl]naphthalen-2-ol;hydrochloride
CID 171264640
1-[(1S)-1-hydroxyethyl]naphthalen-2-ol
CID 95420538
1-[(S)-morpholin-4-yl(phenyl)methyl]naphthalen-2-ol
CID 747708

Frequently Asked Questions

What is the IUPAC name of 1-[(R)-amino(phenyl)methyl]naphthalen-2-ol?
The IUPAC name of 1-[(R)-amino(phenyl)methyl]naphthalen-2-ol (CID 6935961) is 1-[(R)-amino(phenyl)methyl]naphthalen-2-ol.
What is the SMILES notation for 1-[(R)-amino(phenyl)methyl]naphthalen-2-ol?
The canonical SMILES for 1-[(R)-amino(phenyl)methyl]naphthalen-2-ol is N[C@H](c1ccccc1)c1c(O)ccc2ccccc12.
What is the InChIKey of 1-[(R)-amino(phenyl)methyl]naphthalen-2-ol?
The InChIKey is PZMIGEOOGFFCNT-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H15NO/c18-17(13-7-2-1-3-8-13)16-14-9-5-4-6-12(14)10-11-15(16)19/h1-11,17,19H,18H2/t17-/m1/s1.
What are the key properties of 1-[(R)-amino(phenyl)methyl]naphthalen-2-ol?
1-[(R)-amino(phenyl)methyl]naphthalen-2-ol has a molecular weight of 249.31 g/mol, XLogP of 3.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(R)-amino(phenyl)methyl]naphthalen-2-ol is sourced from PubChem (CID 6935961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).