1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride

C16H24ClNO2 — CID 67425201

IUPAC1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride
SMILESCCc1cc2c(c(CC)c1C(N)=O)CCC(OC)C2.Cl
InChIInChI=1S/C16H23NO2.ClH/c1-4-10-8-11-9-12(19-3)6-7-14(11)13(5-2)15(10)16(17)18;/h8,12H,4-7,9H2,1-3H3,(H2,17,18);1H
InChIKeyLPAZKISFTMCRIR-UHFFFAOYSA-N
MW297.83 g/mol
LogP2.84
Rot. Bonds4

About 1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride

1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride (PubChem CID 67425201) has the molecular formula C16H24ClNO2 and a molecular weight of 297.83 g/mol. Its IUPAC name is 1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride
PubChem CID67425201
Molecular FormulaC16H24ClNO2
Molecular Weight297.83 g/mol
Exact Mass297.15
IUPAC Name1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride
SMILESCCc1cc2c(c(CC)c1C(N)=O)CCC(OC)C2.Cl
InChIInChI=1S/C16H23NO2.ClH/c1-4-10-8-11-9-12(19-3)6-7-14(11)13(5-2)15(10)16(17)18;/h8,12H,4-7,9H2,1-3H3,(H2,17,18);1H
InChIKeyLPAZKISFTMCRIR-UHFFFAOYSA-N
XLogP2.84
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.83
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
The IUPAC name of 1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride (CID 67425201) is 1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride.
What is the SMILES notation for 1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
The canonical SMILES for 1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride is CCc1cc2c(c(CC)c1C(N)=O)CCC(OC)C2.Cl.
What is the InChIKey of 1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
The InChIKey is LPAZKISFTMCRIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2.ClH/c1-4-10-8-11-9-12(19-3)6-7-14(11)13(5-2)15(10)16(17)18;/h8,12H,4-7,9H2,1-3H3,(H2,17,18);1H.
What are the key properties of 1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride has a molecular weight of 297.83 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diethyl-6-methoxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride is sourced from PubChem (CID 67425201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).