1-(6-ethoxynaphthalen-2-yl)propan-2-amine

C15H19NO — CID 44590294

IUPAC1-(6-ethoxynaphthalen-2-yl)propan-2-amine
SMILESCCOc1ccc2cc(CC(C)N)ccc2c1
InChIInChI=1S/C15H19NO/c1-3-17-15-7-6-13-9-12(8-11(2)16)4-5-14(13)10-15/h4-7,9-11H,3,8,16H2,1-2H3
InChIKeyRIBPBDJODPIITD-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.13
Rot. Bonds4

About 1-(6-ethoxynaphthalen-2-yl)propan-2-amine

1-(6-ethoxynaphthalen-2-yl)propan-2-amine (PubChem CID 44590294) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 1-(6-ethoxynaphthalen-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(6-ethoxynaphthalen-2-yl)propan-2-amine
PubChem CID44590294
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name1-(6-ethoxynaphthalen-2-yl)propan-2-amine
SMILESCCOc1ccc2cc(CC(C)N)ccc2c1
InChIInChI=1S/C15H19NO/c1-3-17-15-7-6-13-9-12(8-11(2)16)4-5-14(13)10-15/h4-7,9-11H,3,8,16H2,1-2H3
InChIKeyRIBPBDJODPIITD-UHFFFAOYSA-N
XLogP3.13
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6-ethoxynaphthalen-2-yl)propan-2-amine?
The IUPAC name of 1-(6-ethoxynaphthalen-2-yl)propan-2-amine (CID 44590294) is 1-(6-ethoxynaphthalen-2-yl)propan-2-amine.
What is the SMILES notation for 1-(6-ethoxynaphthalen-2-yl)propan-2-amine?
The canonical SMILES for 1-(6-ethoxynaphthalen-2-yl)propan-2-amine is CCOc1ccc2cc(CC(C)N)ccc2c1.
What is the InChIKey of 1-(6-ethoxynaphthalen-2-yl)propan-2-amine?
The InChIKey is RIBPBDJODPIITD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-3-17-15-7-6-13-9-12(8-11(2)16)4-5-14(13)10-15/h4-7,9-11H,3,8,16H2,1-2H3.
What are the key properties of 1-(6-ethoxynaphthalen-2-yl)propan-2-amine?
1-(6-ethoxynaphthalen-2-yl)propan-2-amine has a molecular weight of 229.32 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethoxynaphthalen-2-yl)propan-2-amine is sourced from PubChem (CID 44590294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).