8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol

C16H23NO — CID 11184156

IUPAC8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol
SMILESC=CCN(C)C1CCc2ccc(O)cc2C1(C)C
InChIInChI=1S/C16H23NO/c1-5-10-17(4)15-9-7-12-6-8-13(18)11-14(12)16(15,2)3/h5-6,8,11,15,18H,1,7,9-10H2,2-4H3
InChIKeyRHQPASUQIGVBMR-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.10
Rot. Bonds3

About 8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol

8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol (PubChem CID 11184156) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is 8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol.

Molecular Properties

Compound Name8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol
PubChem CID11184156
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Name8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol
SMILESC=CCN(C)C1CCc2ccc(O)cc2C1(C)C
InChIInChI=1S/C16H23NO/c1-5-10-17(4)15-9-7-12-6-8-13(18)11-14(12)16(15,2)3/h5-6,8,11,15,18H,1,7,9-10H2,2-4H3
InChIKeyRHQPASUQIGVBMR-UHFFFAOYSA-N
XLogP3.10
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol?
The IUPAC name of 8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol (CID 11184156) is 8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol.
What is the SMILES notation for 8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol?
The canonical SMILES for 8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol is C=CCN(C)C1CCc2ccc(O)cc2C1(C)C.
What is the InChIKey of 8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol?
The InChIKey is RHQPASUQIGVBMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-5-10-17(4)15-9-7-12-6-8-13(18)11-14(12)16(15,2)3/h5-6,8,11,15,18H,1,7,9-10H2,2-4H3.
What are the key properties of 8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol?
8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol has a molecular weight of 245.37 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-dimethyl-7-[methyl(prop-2-enyl)amino]-6,7-dihydro-5H-naphthalen-2-ol is sourced from PubChem (CID 11184156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).