(Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one

C19H15NO — CID 170551701

IUPAC(Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one
SMILESN/C(=C\C(=O)c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C19H15NO/c20-18(13-19(21)15-7-2-1-3-8-15)17-11-10-14-6-4-5-9-16(14)12-17/h1-13H,20H2/b18-13-
InChIKeyZGZDTOAFTZFRSK-AQTBWJFISA-N
MW273.33 g/mol
LogP4.02
Rot. Bonds3

About (Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one

(Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one (PubChem CID 170551701) has the molecular formula C19H15NO and a molecular weight of 273.33 g/mol. Its IUPAC name is (Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one.

Molecular Properties

Compound Name(Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one
PubChem CID170551701
Molecular FormulaC19H15NO
Molecular Weight273.33 g/mol
Exact Mass273.12
IUPAC Name(Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one
SMILESN/C(=C\C(=O)c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C19H15NO/c20-18(13-19(21)15-7-2-1-3-8-15)17-11-10-14-6-4-5-9-16(14)12-17/h1-13H,20H2/b18-13-
InChIKeyZGZDTOAFTZFRSK-AQTBWJFISA-N
XLogP4.02
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(Z)-3-amino-1,3-diphenylprop-2-en-1-one
CID 5376383
sodium;3-amino-1,3-diphenylprop-2-en-1-one;hydride
CID 173426238
(Z)-3-amino-1-(4-fluorophenyl)-3-phenylprop-2-en-1-one
CID 102206205
(Z)-3-amino-3-(4-methylphenyl)-1-phenylprop-2-en-1-one
CID 5376861
(E)-3-amino-3-(4-methylphenyl)-1-phenylprop-2-en-1-one
CID 21160961
N-[(E)-3-oxo-1,3-diphenylprop-1-enyl]naphthalene-2-carboxamide
CID 5377898
(Z)-1-naphthalen-2-ylprop-1-en-1-amine
CID 21343656
(E)-3-[(E)-1-naphthalen-2-ylethylideneamino]oxy-1,3-diphenylprop-2-en-1-one
CID 177400988
3-naphthalen-2-yl-3-phenylprop-2-enoic acid
CID 54114059
naphthalen-2-yl(phenyl)(113C)methanone
CID 101359138
(Z)-3-amino-1-[4-(dimethylamino)phenyl]-3-phenylprop-2-en-1-one
CID 102206203
3-imino-1,3-dinaphthalen-2-ylprop-1-en-1-amine
CID 154033384

Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one?
The IUPAC name of (Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one (CID 170551701) is (Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one.
What is the SMILES notation for (Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one?
The canonical SMILES for (Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one is N/C(=C\C(=O)c1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of (Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one?
The InChIKey is ZGZDTOAFTZFRSK-AQTBWJFISA-N. The full InChI is InChI=1S/C19H15NO/c20-18(13-19(21)15-7-2-1-3-8-15)17-11-10-14-6-4-5-9-16(14)12-17/h1-13H,20H2/b18-13-.
What are the key properties of (Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one?
(Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one has a molecular weight of 273.33 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-3-naphthalen-2-yl-1-phenylprop-2-en-1-one is sourced from PubChem (CID 170551701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).