1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine

C15H24N2O2 — CID 79247744

IUPAC1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine
SMILESCOCCNC1(CN)CCCc2ccc(OC)cc21
InChIInChI=1S/C15H24N2O2/c1-18-9-8-17-15(11-16)7-3-4-12-5-6-13(19-2)10-14(12)15/h5-6,10,17H,3-4,7-9,11,16H2,1-2H3
InChIKeyYQIFJENRHIBTIJ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.42
Rot. Bonds6

About 1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine

1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine (PubChem CID 79247744) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine
PubChem CID79247744
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine
SMILESCOCCNC1(CN)CCCc2ccc(OC)cc21
InChIInChI=1S/C15H24N2O2/c1-18-9-8-17-15(11-16)7-3-4-12-5-6-13(19-2)10-14(12)15/h5-6,10,17H,3-4,7-9,11,16H2,1-2H3
InChIKeyYQIFJENRHIBTIJ-UHFFFAOYSA-N
XLogP1.42
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79248601
1-(aminomethyl)-7-methoxy-N-prop-2-ynyl-3,4-dihydro-2H-naphthalen-1-amine
CID 79247899
1-(aminomethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79248291
1-(aminomethyl)-7-methoxy-N,N-dimethyl-3,4-dihydro-2H-naphthalen-1-amine
CID 79248766
2-methoxy-N-[(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methyl]ethanamine
CID 79248469
1-ethyl-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79240760
[6-methoxy-1-(methylamino)-2,3-dihydroinden-1-yl]methanol
CID 79375001
(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine
CID 79247847
ethane;6-methoxy-4,4-dimethyl-2,3-dihydro-1H-naphthalene
CID 143044836
7-methoxy-1-(2,2,2-trifluoroethylamino)-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 79230787
1-hydroxy-7-methoxy-3,4-dihydro-2H-naphthalene-1-carboxylic acid
CID 70241546
2-[(1R)-7-methoxy-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]ethanol
CID 11775651

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine?
The IUPAC name of 1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine (CID 79247744) is 1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine.
What is the SMILES notation for 1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine?
The canonical SMILES for 1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine is COCCNC1(CN)CCCc2ccc(OC)cc21.
What is the InChIKey of 1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine?
The InChIKey is YQIFJENRHIBTIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-18-9-8-17-15(11-16)7-3-4-12-5-6-13(19-2)10-14(12)15/h5-6,10,17H,3-4,7-9,11,16H2,1-2H3.
What are the key properties of 1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine?
1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine has a molecular weight of 264.37 g/mol, XLogP of 1.42, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine is sourced from PubChem (CID 79247744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).