7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine

C19H23NO — CID 79233838

IUPAC7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine
SMILESCOc1ccc2c(c1)C(N)(Cc1ccccc1C)CCC2
InChIInChI=1S/C19H23NO/c1-14-6-3-4-7-16(14)13-19(20)11-5-8-15-9-10-17(21-2)12-18(15)19/h3-4,6-7,9-10,12H,5,8,11,13,20H2,1-2H3
InChIKeyMKNYKTKJPIDCAM-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.74
Rot. Bonds3

About 7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine

7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine (PubChem CID 79233838) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine.

Molecular Properties

Compound Name7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine
PubChem CID79233838
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine
SMILESCOc1ccc2c(c1)C(N)(Cc1ccccc1C)CCC2
InChIInChI=1S/C19H23NO/c1-14-6-3-4-7-16(14)13-19(20)11-5-8-15-9-10-17(21-2)12-18(15)19/h3-4,6-7,9-10,12H,5,8,11,13,20H2,1-2H3
InChIKeyMKNYKTKJPIDCAM-UHFFFAOYSA-N
XLogP3.74
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2-fluorophenyl)methyl]-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79233836
1-(aminomethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79248291
1-ethyl-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79240760
7-methoxy-1-(1,3-thiazol-2-ylmethyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 79824660
1-(4-methoxy-2-methylphenyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 65313131
1-[(2-methoxy-5-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine
CID 62160328
7-methoxy-1-(3-methylsulfonylpropyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 79241254
ethane;6-methoxy-4,4-dimethyl-2,3-dihydro-1H-naphthalene
CID 143044836
1-(2,5-dimethoxyphenyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 62800508
1-[(5-chloro-2-methoxyphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine
CID 62620308
6-methoxy-1-phenyl-2,3-dihydroinden-1-amine
CID 79374582
2-(1-amino-6-methoxy-3,4-dihydro-2H-naphthalen-1-yl)ethanol
CID 65239684

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine?
The IUPAC name of 7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine (CID 79233838) is 7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine.
What is the SMILES notation for 7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine?
The canonical SMILES for 7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine is COc1ccc2c(c1)C(N)(Cc1ccccc1C)CCC2.
What is the InChIKey of 7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine?
The InChIKey is MKNYKTKJPIDCAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-14-6-3-4-7-16(14)13-19(20)11-5-8-15-9-10-17(21-2)12-18(15)19/h3-4,6-7,9-10,12H,5,8,11,13,20H2,1-2H3.
What are the key properties of 7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine?
7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine has a molecular weight of 281.40 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-1-[(2-methylphenyl)methyl]-3,4-dihydro-2H-naphthalen-1-amine is sourced from PubChem (CID 79233838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).