1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine

C20H21NO2 — CID 19884989

IUPAC1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine
SMILESCOc1ccccc1C(N)CCOc1cccc2ccccc12
InChIInChI=1S/C20H21NO2/c1-22-19-11-5-4-10-17(19)18(21)13-14-23-20-12-6-8-15-7-2-3-9-16(15)20/h2-12,18H,13-14,21H2,1H3
InChIKeyMONUQXMCZXATBL-UHFFFAOYSA-N
MW307.39 g/mol
LogP4.32
Rot. Bonds6

About 1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine

1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine (PubChem CID 19884989) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine
PubChem CID19884989
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC Name1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine
SMILESCOc1ccccc1C(N)CCOc1cccc2ccccc12
InChIInChI=1S/C20H21NO2/c1-22-19-11-5-4-10-17(19)18(21)13-14-23-20-12-6-8-15-7-2-3-9-16(15)20/h2-12,18H,13-14,21H2,1H3
InChIKeyMONUQXMCZXATBL-UHFFFAOYSA-N
XLogP4.32
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-(2-methoxyphenyl)propane-1,3-diamine
CID 171219974
2-methoxy-1-naphthalen-1-ylethanamine
CID 16790923
(2S)-2-amino-4-naphthalen-1-yloxybutanamide
CID 174561854
2-amino-4-naphthalen-1-yloxybutanamide
CID 63040100
1-(4-methylpentoxy)naphthalene
CID 83168126
(1R)-4,4,4-trifluoro-1-(2-methoxyphenyl)butan-1-amine
CID 171200452
(1S)-1-(2-methoxyphenyl)butane-1,4-diamine;hydrochloride
CID 171219977
(1S)-4,4,4-trifluoro-1-(2-methoxyphenyl)butan-1-amine
CID 171219989
(1S)-1-(2-methoxyphenyl)ethane-1,2-diamine
CID 51699599
1-(2-methoxyphenyl)pent-4-en-1-amine
CID 15884723
(2S)-2-amino-6-naphthalen-1-yloxyhexane-1-thiol
CID 87875984
4-methoxy-4-methyl-1-naphthalen-1-ylpentan-1-amine
CID 103031528

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine?
The IUPAC name of 1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine (CID 19884989) is 1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine.
What is the SMILES notation for 1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine?
The canonical SMILES for 1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine is COc1ccccc1C(N)CCOc1cccc2ccccc12.
What is the InChIKey of 1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine?
The InChIKey is MONUQXMCZXATBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO2/c1-22-19-11-5-4-10-17(19)18(21)13-14-23-20-12-6-8-15-7-2-3-9-16(15)20/h2-12,18H,13-14,21H2,1H3.
What are the key properties of 1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine?
1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine has a molecular weight of 307.39 g/mol, XLogP of 4.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-3-naphthalen-1-yloxypropan-1-amine is sourced from PubChem (CID 19884989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).