6,7-diethyl-1,2-dihydronaphthalen-2-amine

C14H19N — CID 123225585

IUPAC6,7-diethyl-1,2-dihydronaphthalen-2-amine
SMILESCCc1cc2c(cc1CC)CC(N)C=C2
InChIInChI=1S/C14H19N/c1-3-10-7-12-5-6-14(15)9-13(12)8-11(10)4-2/h5-8,14H,3-4,9,15H2,1-2H3
InChIKeyCZYOXNKPCZJMOD-UHFFFAOYSA-N
MW201.31 g/mol
LogP2.71
Rot. Bonds2

About 6,7-diethyl-1,2-dihydronaphthalen-2-amine

6,7-diethyl-1,2-dihydronaphthalen-2-amine (PubChem CID 123225585) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 6,7-diethyl-1,2-dihydronaphthalen-2-amine.

Molecular Properties

Compound Name6,7-diethyl-1,2-dihydronaphthalen-2-amine
PubChem CID123225585
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name6,7-diethyl-1,2-dihydronaphthalen-2-amine
SMILESCCc1cc2c(cc1CC)CC(N)C=C2
InChIInChI=1S/C14H19N/c1-3-10-7-12-5-6-14(15)9-13(12)8-11(10)4-2/h5-8,14H,3-4,9,15H2,1-2H3
InChIKeyCZYOXNKPCZJMOD-UHFFFAOYSA-N
XLogP2.71
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6,7-diethyl-1,2-dihydronaphthalen-2-amine?
The IUPAC name of 6,7-diethyl-1,2-dihydronaphthalen-2-amine (CID 123225585) is 6,7-diethyl-1,2-dihydronaphthalen-2-amine.
What is the SMILES notation for 6,7-diethyl-1,2-dihydronaphthalen-2-amine?
The canonical SMILES for 6,7-diethyl-1,2-dihydronaphthalen-2-amine is CCc1cc2c(cc1CC)CC(N)C=C2.
What is the InChIKey of 6,7-diethyl-1,2-dihydronaphthalen-2-amine?
The InChIKey is CZYOXNKPCZJMOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-3-10-7-12-5-6-14(15)9-13(12)8-11(10)4-2/h5-8,14H,3-4,9,15H2,1-2H3.
What are the key properties of 6,7-diethyl-1,2-dihydronaphthalen-2-amine?
6,7-diethyl-1,2-dihydronaphthalen-2-amine has a molecular weight of 201.31 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-diethyl-1,2-dihydronaphthalen-2-amine is sourced from PubChem (CID 123225585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).