2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine

C18H21NO — CID 62801884

IUPAC2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine
SMILESCCOc1ccccc1C1(N)CCc2ccccc2C1
InChIInChI=1S/C18H21NO/c1-2-20-17-10-6-5-9-16(17)18(19)12-11-14-7-3-4-8-15(14)13-18/h3-10H,2,11-13,19H2,1H3
InChIKeyULNQTNFSPNOGKF-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.43
Rot. Bonds3

About 2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine

2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine (PubChem CID 62801884) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine
PubChem CID62801884
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine
SMILESCCOc1ccccc1C1(N)CCc2ccccc2C1
InChIInChI=1S/C18H21NO/c1-2-20-17-10-6-5-9-16(17)18(19)12-11-14-7-3-4-8-15(14)13-18/h3-10H,2,11-13,19H2,1H3
InChIKeyULNQTNFSPNOGKF-UHFFFAOYSA-N
XLogP3.43
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine?
The IUPAC name of 2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine (CID 62801884) is 2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine.
What is the SMILES notation for 2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine?
The canonical SMILES for 2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine is CCOc1ccccc1C1(N)CCc2ccccc2C1.
What is the InChIKey of 2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine?
The InChIKey is ULNQTNFSPNOGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-2-20-17-10-6-5-9-16(17)18(19)12-11-14-7-3-4-8-15(14)13-18/h3-10H,2,11-13,19H2,1H3.
What are the key properties of 2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine?
2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine has a molecular weight of 267.37 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-3,4-dihydro-1H-naphthalen-2-amine is sourced from PubChem (CID 62801884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).