1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine

C22H19N — CID 174325640

IUPAC1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine
SMILESCCc1c(Nc2ccc3ccccc3c2)ccc2ccccc12
InChIInChI=1S/C22H19N/c1-2-20-21-10-6-5-8-17(21)12-14-22(20)23-19-13-11-16-7-3-4-9-18(16)15-19/h3-15,23H,2H2,1H3
InChIKeyLQYIEHBRWDWGBJ-UHFFFAOYSA-N
MW297.40 g/mol
LogP6.30
Rot. Bonds3

About 1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine

1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine (PubChem CID 174325640) has the molecular formula C22H19N and a molecular weight of 297.40 g/mol. Its IUPAC name is 1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine.

Molecular Properties

Compound Name1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine
PubChem CID174325640
Molecular FormulaC22H19N
Molecular Weight297.40 g/mol
Exact Mass297.15
IUPAC Name1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine
SMILESCCc1c(Nc2ccc3ccccc3c2)ccc2ccccc12
InChIInChI=1S/C22H19N/c1-2-20-21-10-6-5-8-17(21)12-14-22(20)23-19-13-11-16-7-3-4-9-18(16)15-19/h3-15,23H,2H2,1H3
InChIKeyLQYIEHBRWDWGBJ-UHFFFAOYSA-N
XLogP6.30
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500297.40
LogP ≤ 56.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine?
The IUPAC name of 1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine (CID 174325640) is 1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine.
What is the SMILES notation for 1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine?
The canonical SMILES for 1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine is CCc1c(Nc2ccc3ccccc3c2)ccc2ccccc12.
What is the InChIKey of 1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine?
The InChIKey is LQYIEHBRWDWGBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N/c1-2-20-21-10-6-5-8-17(21)12-14-22(20)23-19-13-11-16-7-3-4-9-18(16)15-19/h3-15,23H,2H2,1H3.
What are the key properties of 1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine?
1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine has a molecular weight of 297.40 g/mol, XLogP of 6.30, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-naphthalen-2-ylnaphthalen-2-amine is sourced from PubChem (CID 174325640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).