(1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine

C19H19NO — CID 78933581

IUPAC(1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine
SMILESC[C@H](N)c1ccc(OCc2cccc3ccccc23)cc1
InChIInChI=1S/C19H19NO/c1-14(20)15-9-11-18(12-10-15)21-13-17-7-4-6-16-5-2-3-8-19(16)17/h2-12,14H,13,20H2,1H3/t14-/m0/s1
InChIKeyKOAJUCHAZAKOSV-AWEZNQCLSA-N
MW277.37 g/mol
LogP4.44
Rot. Bonds4

About (1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine

(1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine (PubChem CID 78933581) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is (1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine.

Molecular Properties

Compound Name(1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine
PubChem CID78933581
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name(1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine
SMILESC[C@H](N)c1ccc(OCc2cccc3ccccc23)cc1
InChIInChI=1S/C19H19NO/c1-14(20)15-9-11-18(12-10-15)21-13-17-7-4-6-16-5-2-3-8-19(16)17/h2-12,14H,13,20H2,1H3/t14-/m0/s1
InChIKeyKOAJUCHAZAKOSV-AWEZNQCLSA-N
XLogP4.44
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-[(2-chlorophenyl)methoxy]phenyl]ethanamine
CID 43189009
1-(phenoxymethyl)naphthalene
CID 588110
1-[2-(naphthalen-1-ylmethoxy)phenyl]ethanamine
CID 60880695
3-[[4-[(1S)-1-aminoethyl]phenoxy]methyl]-2-fluorobenzonitrile
CID 107114258
4-(naphthalen-1-ylmethoxy)-N-phenylaniline
CID 145256438
1-[4-[(2-methyl-3-nitrophenyl)methoxy]phenyl]ethanamine
CID 60877871
ethane;(1S)-1-[4-(phenoxymethyl)phenyl]ethanamine
CID 154659540
(1R)-1-[4-(pyridin-2-ylmethoxy)phenyl]ethanamine
CID 30121102
4-(naphthalen-1-ylmethoxy)benzohydrazide
CID 91683225
1-[4-(3-phenoxypropoxy)phenyl]ethanamine
CID 13012117
CID 67883357
CID 67883357
(1S)-1-[4-[(4-propan-2-ylphenyl)methoxy]phenyl]ethanamine
CID 28973753

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine?
The IUPAC name of (1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine (CID 78933581) is (1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine.
What is the SMILES notation for (1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine?
The canonical SMILES for (1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine is C[C@H](N)c1ccc(OCc2cccc3ccccc23)cc1.
What is the InChIKey of (1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine?
The InChIKey is KOAJUCHAZAKOSV-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H19NO/c1-14(20)15-9-11-18(12-10-15)21-13-17-7-4-6-16-5-2-3-8-19(16)17/h2-12,14H,13,20H2,1H3/t14-/m0/s1.
What are the key properties of (1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine?
(1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine has a molecular weight of 277.37 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[4-(naphthalen-1-ylmethoxy)phenyl]ethanamine is sourced from PubChem (CID 78933581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).