[1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine

C19H23NO — CID 102940470

IUPAC[1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine
SMILESNCC1(COCc2ccccc2)CCCc2ccccc21
InChIInChI=1S/C19H23NO/c20-14-19(15-21-13-16-7-2-1-3-8-16)12-6-10-17-9-4-5-11-18(17)19/h1-5,7-9,11H,6,10,12-15,20H2
InChIKeyAXIMALDMYAXVPW-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.44
Rot. Bonds5

About [1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine

[1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine (PubChem CID 102940470) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is [1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine.

Molecular Properties

Compound Name[1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine
PubChem CID102940470
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name[1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine
SMILESNCC1(COCc2ccccc2)CCCc2ccccc21
InChIInChI=1S/C19H23NO/c20-14-19(15-21-13-16-7-2-1-3-8-16)12-6-10-17-9-4-5-11-18(17)19/h1-5,7-9,11H,6,10,12-15,20H2
InChIKeyAXIMALDMYAXVPW-UHFFFAOYSA-N
XLogP3.44
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[2-(2,2,2-trifluoroethoxy)ethyl]-3,4-dihydro-2H-naphthalen-1-yl]methanamine
CID 62724312
[1-(2-methylbutyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine
CID 63521983
4,4-diethyl-2,3-dihydro-1H-naphthalene
CID 520431
(1-ethyl-3,4-dihydro-2H-naphthalen-1-yl)methanol
CID 66059601
[1-[(4-chloro-3-fluorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanamine
CID 107897274
1-(aminomethyl)-3,4-dihydro-2H-naphthalen-1-ol
CID 12914859
[(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine
CID 94565802
[1-[(2,5-dichlorophenyl)methyl]-3,4-dihydro-2H-naphthalen-1-yl]methanamine
CID 65318575
1-(2-hydroxy-3-phenylmethoxypropyl)-3,4-dihydro-2H-naphthalene-1-carboxylic acid
CID 113247766
2-[1-(phenylmethoxymethyl)cyclopropyl]ethanamine
CID 65480359
3-[2-[1-(chloromethyl)-3,4-dihydro-2H-naphthalen-1-yl]ethyl]thiophene
CID 66033638
1-[1-(methoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]-N-methylmethanamine
CID 103984610

Frequently Asked Questions

What is the IUPAC name of [1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine?
The IUPAC name of [1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine (CID 102940470) is [1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine.
What is the SMILES notation for [1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine?
The canonical SMILES for [1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine is NCC1(COCc2ccccc2)CCCc2ccccc21.
What is the InChIKey of [1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine?
The InChIKey is AXIMALDMYAXVPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c20-14-19(15-21-13-16-7-2-1-3-8-16)12-6-10-17-9-4-5-11-18(17)19/h1-5,7-9,11H,6,10,12-15,20H2.
What are the key properties of [1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine?
[1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine has a molecular weight of 281.40 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(phenylmethoxymethyl)-3,4-dihydro-2H-naphthalen-1-yl]methanamine is sourced from PubChem (CID 102940470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).