1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine

C14H19NO — CID 70917892

IUPAC1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine
SMILESCOC1C=c2ccc(CC(C)N)cc2=CC1
InChIInChI=1S/C14H19NO/c1-10(15)7-11-3-4-13-9-14(16-2)6-5-12(13)8-11/h3-5,8-10,14H,6-7,15H2,1-2H3
InChIKeyLCSUYVVWLQLLLP-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.56
Rot. Bonds3

About 1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine

1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine (PubChem CID 70917892) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine
PubChem CID70917892
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine
SMILESCOC1C=c2ccc(CC(C)N)cc2=CC1
InChIInChI=1S/C14H19NO/c1-10(15)7-11-3-4-13-9-14(16-2)6-5-12(13)8-11/h3-5,8-10,14H,6-7,15H2,1-2H3
InChIKeyLCSUYVVWLQLLLP-UHFFFAOYSA-N
XLogP0.56
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine?
The IUPAC name of 1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine (CID 70917892) is 1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine.
What is the SMILES notation for 1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine?
The canonical SMILES for 1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine is COC1C=c2ccc(CC(C)N)cc2=CC1.
What is the InChIKey of 1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine?
The InChIKey is LCSUYVVWLQLLLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-10(15)7-11-3-4-13-9-14(16-2)6-5-12(13)8-11/h3-5,8-10,14H,6-7,15H2,1-2H3.
What are the key properties of 1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine?
1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine has a molecular weight of 217.31 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-6,7-dihydronaphthalen-2-yl)propan-2-amine is sourced from PubChem (CID 70917892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).