2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine

C14H19NO — CID 105471629

IUPAC2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine
SMILESCOc1ccc2c(c1)CCC(C(C)(C)N)=C2
InChIInChI=1S/C14H19NO/c1-14(2,15)12-6-4-11-9-13(16-3)7-5-10(11)8-12/h5,7-9H,4,6,15H2,1-3H3
InChIKeyKQBJCICOLYIXKJ-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.76
Rot. Bonds2

About 2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine

2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine (PubChem CID 105471629) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine.

Molecular Properties

Compound Name2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine
PubChem CID105471629
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine
SMILESCOc1ccc2c(c1)CCC(C(C)(C)N)=C2
InChIInChI=1S/C14H19NO/c1-14(2,15)12-6-4-11-9-13(16-3)7-5-10(11)8-12/h5,7-9H,4,6,15H2,1-3H3
InChIKeyKQBJCICOLYIXKJ-UHFFFAOYSA-N
XLogP2.76
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-methoxy-3-(trifluoromethyl)-1,2-dihydronaphthalene
CID 132552094
2,6-dimethoxy-8,9-dihydro-7H-benzo[7]annulene
CID 143787705
3-(2,4-dimethoxyphenyl)-7-methoxy-1,2-dihydronaphthalene
CID 57081453
3-(6-methoxy-3,4-dihydronaphthalen-2-yl)propane-1,2-diamine
CID 10681104
7-methoxy-3-(1-methoxypropyl)-1,2-dihydronaphthalene
CID 143846492
1-(6-methoxy-3,4-dihydronaphthalen-2-yl)ethylurea
CID 152747543
[(5E)-2-methoxy-7,8,9,10-tetrahydrobenzo[8]annulen-6-yl] trifluoromethanesulfonate
CID 155222030
3,7-dimethoxy-1H-naphthalen-2-one
CID 142704894
3,6-dimethoxy-1,2-dihydronaphthalene
CID 13364263
13-methoxy-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),2,12,14-tetraen-5-one
CID 3662313
2-(6-methoxy-3,4-dihydronaphthalen-2-yl)benzenesulfinic acid
CID 163478631
3-(2-chloro-4-fluoro-3-methoxyphenyl)-7-methoxy-1,2-dihydronaphthalene
CID 54050552

Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine?
The IUPAC name of 2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine (CID 105471629) is 2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine.
What is the SMILES notation for 2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine?
The canonical SMILES for 2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine is COc1ccc2c(c1)CCC(C(C)(C)N)=C2.
What is the InChIKey of 2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine?
The InChIKey is KQBJCICOLYIXKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-14(2,15)12-6-4-11-9-13(16-3)7-5-10(11)8-12/h5,7-9H,4,6,15H2,1-3H3.
What are the key properties of 2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine?
2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine has a molecular weight of 217.31 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine is sourced from PubChem (CID 105471629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).