methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate

C16H23NO3 — CID 65234712

IUPACmethyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate
SMILESCCNC1(CC(=O)OC)CCCc2cc(OC)ccc21
InChIInChI=1S/C16H23NO3/c1-4-17-16(11-15(18)20-3)9-5-6-12-10-13(19-2)7-8-14(12)16/h7-8,10,17H,4-6,9,11H2,1-3H3
InChIKeyCNMQTSFJFHZNDJ-UHFFFAOYSA-N
MW277.36 g/mol
LogP2.40
Rot. Bonds5

About methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate

methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate (PubChem CID 65234712) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate.

Molecular Properties

Compound Namemethyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate
PubChem CID65234712
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC Namemethyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate
SMILESCCNC1(CC(=O)OC)CCCc2cc(OC)ccc21
InChIInChI=1S/C16H23NO3/c1-4-17-16(11-15(18)20-3)9-5-6-12-10-13(19-2)7-8-14(12)16/h7-8,10,17H,4-6,9,11H2,1-3H3
InChIKeyCNMQTSFJFHZNDJ-UHFFFAOYSA-N
XLogP2.40
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-[2-(ethylamino)-7-methoxy-3,4-dihydro-1H-naphthalen-2-yl]acetate
CID 115511201
ethyl 2-[1-(ethylamino)-3,4-dihydro-2H-naphthalen-1-yl]acetate
CID 65234108
ethyl 2-(6-methoxy-1-methyl-3,4-dihydro-2H-naphthalen-1-yl)acetate
CID 101340155
6-methoxy-1-(propylamino)-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 60796789
methyl 2-[5-fluoro-1-(propylamino)-2,3-dihydroinden-1-yl]acetate
CID 116532392
2-ethoxy-N-[(1-hydroxy-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl)methyl]acetamide
CID 91631099
methyl 1-(cyclopropylmethylamino)-6-methoxy-3,4-dihydro-2H-naphthalene-1-carboxylate
CID 61001121
2-(ethylamino)-7-methoxy-3,4-dihydro-1H-naphthalene-2-carboxylic acid
CID 115510779
[6-methoxy-1-(oxolan-2-ylmethylamino)-3,4-dihydro-2H-naphthalen-1-yl]methanol
CID 61049568
methyl 7-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxylate
CID 122463537
5-ethyl-2-methoxy-6-(4-methoxyphenyl)-6-methyl-8,9-dihydro-7H-benzo[7]annulen-5-ol
CID 68730786
N-[[(1S)-1-hydroxy-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]methyl]-2,2-dimethylpropanamide
CID 100730792

Frequently Asked Questions

What is the IUPAC name of methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate?
The IUPAC name of methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate (CID 65234712) is methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate.
What is the SMILES notation for methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate?
The canonical SMILES for methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate is CCNC1(CC(=O)OC)CCCc2cc(OC)ccc21.
What is the InChIKey of methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate?
The InChIKey is CNMQTSFJFHZNDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c1-4-17-16(11-15(18)20-3)9-5-6-12-10-13(19-2)7-8-14(12)16/h7-8,10,17H,4-6,9,11H2,1-3H3.
What are the key properties of methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate?
methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate has a molecular weight of 277.36 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[1-(ethylamino)-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl]acetate is sourced from PubChem (CID 65234712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).