1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol

C14H17NO — CID 39345560

IUPAC1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol
SMILESCC(C)[C@@H](N)c1c(O)ccc2ccccc12
InChIInChI=1S/C14H17NO/c1-9(2)14(15)13-11-6-4-3-5-10(11)7-8-12(13)16/h3-9,14,16H,15H2,1-2H3/t14-/m1/s1
InChIKeyMYFKTRVPAJLXPM-CQSZACIVSA-N
MW215.30 g/mol
LogP3.20
Rot. Bonds2

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

1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol (PubChem CID 39345560) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol
PubChem CID39345560
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol
SMILESCC(C)[C@@H](N)c1c(O)ccc2ccccc12
InChIInChI=1S/C14H17NO/c1-9(2)14(15)13-11-6-4-3-5-10(11)7-8-12(13)16/h3-9,14,16H,15H2,1-2H3/t14-/m1/s1
InChIKeyMYFKTRVPAJLXPM-CQSZACIVSA-N
XLogP3.20
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.20
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-[(1R,2S)-1-amino-2-hydroxypropyl]naphthalen-2-ol;hydrochloride
CID 171264640
1-[(1S)-1-aminopropyl]naphthalen-2-ol
CID 93030603
1-[(1S)-1-hydroxyethyl]naphthalen-2-ol
CID 95420538
1-(1-amino-2-hydroxyethyl)naphthalen-2-ol
CID 77129792
1-[(1R)-1,2-diaminoethyl]naphthalen-2-ol;hydrochloride
CID 171232039
1-[(R)-amino(phenyl)methyl]naphthalen-2-ol
CID 6935961
1-but-3-en-2-ylnaphthalen-2-ol
CID 15324471
1-(1-amino-3-hydroxypropyl)naphthalen-2-ol;hydrochloride
CID 170874425
3-amino-3-(2-hydroxynaphthalen-1-yl)propanamide
CID 170875681
1-[(1R)-1-amino-3,3,3-trifluoropropyl]naphthalen-2-ol;hydrochloride
CID 171212454
1-[(1S)-1-aminobut-3-enyl]naphthalen-2-ol;hydrochloride
CID 171232050
1-[(R)-amino(thiophen-2-yl)methyl]naphthalen-2-ol
CID 171232072

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol?
The IUPAC name of 1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol (CID 39345560) is 1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol.
What is the SMILES notation for 1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol?
The canonical SMILES for 1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol is CC(C)[C@@H](N)c1c(O)ccc2ccccc12.
What is the InChIKey of 1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol?
The InChIKey is MYFKTRVPAJLXPM-CQSZACIVSA-N. The full InChI is InChI=1S/C14H17NO/c1-9(2)14(15)13-11-6-4-3-5-10(11)7-8-12(13)16/h3-9,14,16H,15H2,1-2H3/t14-/m1/s1.
What are the key properties of 1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol?
1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol has a molecular weight of 215.30 g/mol, XLogP of 3.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-amino-2-methylpropyl]naphthalen-2-ol is sourced from PubChem (CID 39345560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).