N-(2-prop-2-enylphenyl)naphthalen-2-amine

C19H17N — CID 66931436

IUPACN-(2-prop-2-enylphenyl)naphthalen-2-amine
SMILESC=CCc1ccccc1Nc1ccc2ccccc2c1
InChIInChI=1S/C19H17N/c1-2-7-16-9-5-6-11-19(16)20-18-13-12-15-8-3-4-10-17(15)14-18/h2-6,8-14,20H,1,7H2
InChIKeyKPCWVVSJWZCDGT-UHFFFAOYSA-N
MW259.35 g/mol
LogP5.31
Rot. Bonds4

About N-(2-prop-2-enylphenyl)naphthalen-2-amine

N-(2-prop-2-enylphenyl)naphthalen-2-amine (PubChem CID 66931436) has the molecular formula C19H17N and a molecular weight of 259.35 g/mol. Its IUPAC name is N-(2-prop-2-enylphenyl)naphthalen-2-amine.

Molecular Properties

Compound NameN-(2-prop-2-enylphenyl)naphthalen-2-amine
PubChem CID66931436
Molecular FormulaC19H17N
Molecular Weight259.35 g/mol
Exact Mass259.14
IUPAC NameN-(2-prop-2-enylphenyl)naphthalen-2-amine
SMILESC=CCc1ccccc1Nc1ccc2ccccc2c1
InChIInChI=1S/C19H17N/c1-2-7-16-9-5-6-11-19(16)20-18-13-12-15-8-3-4-10-17(15)14-18/h2-6,8-14,20H,1,7H2
InChIKeyKPCWVVSJWZCDGT-UHFFFAOYSA-N
XLogP5.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.35
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 N-(2-prop-2-enylphenyl)naphthalen-2-amine?
The IUPAC name of N-(2-prop-2-enylphenyl)naphthalen-2-amine (CID 66931436) is N-(2-prop-2-enylphenyl)naphthalen-2-amine.
What is the SMILES notation for N-(2-prop-2-enylphenyl)naphthalen-2-amine?
The canonical SMILES for N-(2-prop-2-enylphenyl)naphthalen-2-amine is C=CCc1ccccc1Nc1ccc2ccccc2c1.
What is the InChIKey of N-(2-prop-2-enylphenyl)naphthalen-2-amine?
The InChIKey is KPCWVVSJWZCDGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N/c1-2-7-16-9-5-6-11-19(16)20-18-13-12-15-8-3-4-10-17(15)14-18/h2-6,8-14,20H,1,7H2.
What are the key properties of N-(2-prop-2-enylphenyl)naphthalen-2-amine?
N-(2-prop-2-enylphenyl)naphthalen-2-amine has a molecular weight of 259.35 g/mol, XLogP of 5.31, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-prop-2-enylphenyl)naphthalen-2-amine is sourced from PubChem (CID 66931436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).