2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol

C14H17NO2 — CID 61055521

IUPAC2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol
SMILESCNC(CO)c1c(OC)ccc2ccccc12
InChIInChI=1S/C14H17NO2/c1-15-12(9-16)14-11-6-4-3-5-10(11)7-8-13(14)17-2/h3-8,12,15-16H,9H2,1-2H3
InChIKeyLYFJRDAPEXALIY-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.10
Rot. Bonds4

About 2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol

2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol (PubChem CID 61055521) has the molecular formula C14H17NO2 and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol.

Molecular Properties

Compound Name2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol
PubChem CID61055521
Molecular FormulaC14H17NO2
Molecular Weight231.30 g/mol
Exact Mass231.13
IUPAC Name2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol
SMILESCNC(CO)c1c(OC)ccc2ccccc12
InChIInChI=1S/C14H17NO2/c1-15-12(9-16)14-11-6-4-3-5-10(11)7-8-13(14)17-2/h3-8,12,15-16H,9H2,1-2H3
InChIKeyLYFJRDAPEXALIY-UHFFFAOYSA-N
XLogP2.10
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxynaphthalen-1-yl)-N-propan-2-ylethane-1,2-diamine
CID 62069963
3-acetamido-3-(2-methoxynaphthalen-1-yl)propanoic acid
CID 63650219
(3R)-3-acetamido-3-(2-methoxynaphthalen-1-yl)propanoic acid
CID 63649897
methyl 2-chloro-2-(2-methoxynaphthalen-1-yl)acetate
CID 62224921
1-(2-methoxynaphthalen-1-yl)-3-methylbutan-1-ol
CID 63895549
(3S)-3-amino-3-(2-methoxynaphthalen-1-yl)-2,2-dimethylpropan-1-ol
CID 171243957
N-(2,2-difluoroethyl)-1-(2-methoxynaphthalen-1-yl)ethane-1,2-diamine
CID 115406276
1-(2-methoxynaphthalen-1-yl)-4-methylpentan-1-ol
CID 65146073
1-(2-methoxynaphthalen-1-yl)-N,N-dimethylethane-1,2-diamine
CID 43380372
methyl (3S)-3-amino-3-(2-methoxynaphthalen-1-yl)propanoate
CID 61150374
(3R)-3-amino-2,2-difluoro-3-(2-methoxynaphthalen-1-yl)propan-1-ol
CID 171243959
1-(diphenoxymethyl)-2-methoxynaphthalene
CID 140773856

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol?
The IUPAC name of 2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol (CID 61055521) is 2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol.
What is the SMILES notation for 2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol?
The canonical SMILES for 2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol is CNC(CO)c1c(OC)ccc2ccccc12.
What is the InChIKey of 2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol?
The InChIKey is LYFJRDAPEXALIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-15-12(9-16)14-11-6-4-3-5-10(11)7-8-13(14)17-2/h3-8,12,15-16H,9H2,1-2H3.
What are the key properties of 2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol?
2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol has a molecular weight of 231.30 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxynaphthalen-1-yl)-2-(methylamino)ethanol is sourced from PubChem (CID 61055521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).