(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine

C18H23NO2 — CID 63368500

IUPAC(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine
SMILESC[C@@H](N)c1ccc2ccccc2c1OCC1CCCCO1
InChIInChI=1S/C18H23NO2/c1-13(19)16-10-9-14-6-2-3-8-17(14)18(16)21-12-15-7-4-5-11-20-15/h2-3,6,8-10,13,15H,4-5,7,11-12,19H2,1H3/t13-,15?/m1/s1
InChIKeyBEZJOAMTMHZVQN-AFYYWNPRSA-N
MW285.39 g/mol
LogP3.81
Rot. Bonds4

About (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine

(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine (PubChem CID 63368500) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine
PubChem CID63368500
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine
SMILESC[C@@H](N)c1ccc2ccccc2c1OCC1CCCCO1
InChIInChI=1S/C18H23NO2/c1-13(19)16-10-9-14-6-2-3-8-17(14)18(16)21-12-15-7-4-5-11-20-15/h2-3,6,8-10,13,15H,4-5,7,11-12,19H2,1H3/t13-,15?/m1/s1
InChIKeyBEZJOAMTMHZVQN-AFYYWNPRSA-N
XLogP3.81
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanol
CID 78933863
1-[1-[2-(oxolan-2-yl)ethoxy]naphthalen-2-yl]ethanamine
CID 65158928
(1R)-1-[1-(cyclopropylmethoxy)naphthalen-2-yl]ethanamine
CID 78937490
1-(1-cyclohexyloxynaphthalen-2-yl)ethanamine
CID 43475177
2-[2-(oxan-2-ylmethoxy)naphthalen-1-yl]ethanamine
CID 60905678
1-(2-methylphenyl)-1-(oxan-2-ylmethoxy)propan-2-amine
CID 55019249
2-[2-(1-aminoethyl)naphthalen-1-yl]oxycyclohexan-1-ol
CID 60889031
1-[3,5-dibromo-4-(oxan-2-ylmethoxy)phenyl]propan-2-amine
CID 107739802
1-[3-bromo-2-(oxan-2-ylmethoxy)phenyl]propan-2-amine
CID 61392575
(1S)-1-[2-(oxolan-2-ylmethoxy)phenyl]propan-1-amine
CID 78932149
4-[2-(oxan-2-ylmethoxy)naphthalen-1-yl]benzamide
CID 172666445
(1S)-1-[5-fluoro-2-(oxolan-2-ylmethoxy)phenyl]ethanamine
CID 78937766

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine?
The IUPAC name of (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine (CID 63368500) is (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine.
What is the SMILES notation for (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine?
The canonical SMILES for (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine is C[C@@H](N)c1ccc2ccccc2c1OCC1CCCCO1.
What is the InChIKey of (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine?
The InChIKey is BEZJOAMTMHZVQN-AFYYWNPRSA-N. The full InChI is InChI=1S/C18H23NO2/c1-13(19)16-10-9-14-6-2-3-8-17(14)18(16)21-12-15-7-4-5-11-20-15/h2-3,6,8-10,13,15H,4-5,7,11-12,19H2,1H3/t13-,15?/m1/s1.
What are the key properties of (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine?
(1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine has a molecular weight of 285.39 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[1-(oxan-2-ylmethoxy)naphthalen-2-yl]ethanamine is sourced from PubChem (CID 63368500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).