(E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide

C19H14FNO — CID 8762219

IUPAC(E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide
SMILESO=C(/C=C/c1ccccc1F)Nc1ccc2ccccc2c1
InChIInChI=1S/C19H14FNO/c20-18-8-4-3-6-15(18)10-12-19(22)21-17-11-9-14-5-1-2-7-16(14)13-17/h1-13H,(H,21,22)/b12-10+
InChIKeyQMVRAWQBVZUVJV-ZRDIBKRKSA-N
MW291.32 g/mol
LogP4.63
Rot. Bonds3

About (E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide

(E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide (PubChem CID 8762219) has the molecular formula C19H14FNO and a molecular weight of 291.32 g/mol. Its IUPAC name is (E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide
PubChem CID8762219
Molecular FormulaC19H14FNO
Molecular Weight291.32 g/mol
Exact Mass291.11
IUPAC Name(E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide
SMILESO=C(/C=C/c1ccccc1F)Nc1ccc2ccccc2c1
InChIInChI=1S/C19H14FNO/c20-18-8-4-3-6-15(18)10-12-19(22)21-17-11-9-14-5-1-2-7-16(14)13-17/h1-13H,(H,21,22)/b12-10+
InChIKeyQMVRAWQBVZUVJV-ZRDIBKRKSA-N
XLogP4.63
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.32
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-3-(2-fluorophenyl)-N-(3-fluorophenyl)prop-2-enamide
CID 8761062
N-(4-acetamidophenyl)-3-(2-fluorophenyl)prop-2-enamide
CID 3454978
(E)-3-(2-fluorophenyl)-N-(4-phenoxyphenyl)prop-2-enamide
CID 7914871
(E)-N-(3-bromophenyl)-3-(2-fluorophenyl)prop-2-enamide
CID 8713833
(E)-3-(2-fluorophenyl)-N-[3-[(2,2,2-trifluoroacetyl)amino]phenyl]prop-2-enamide
CID 108933370
N-naphthalen-2-yl-3-thiophen-2-ylprop-2-enamide
CID 3594199
(E)-N-(4-cyanophenyl)-3-(2-fluorophenyl)prop-2-enamide
CID 26289833
methyl 3-[[(E)-3-(2-fluorophenyl)prop-2-enoyl]amino]benzoate
CID 26240448
4-(naphthalen-2-ylamino)-4-oxobut-2-enoic acid
CID 740391
(E)-3-(2-fluorophenyl)-N-[4-(3-methylphenoxy)phenyl]prop-2-enamide
CID 7925007
2-chloro-N,N-diethyl-4-[[(E)-3-(2-fluorophenyl)prop-2-enoyl]amino]benzamide
CID 55673169
(E)-3-(4-tert-butylphenyl)-N-naphthalen-2-ylprop-2-enamide
CID 6273647

Frequently Asked Questions

What is the IUPAC name of (E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide?
The IUPAC name of (E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide (CID 8762219) is (E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide.
What is the SMILES notation for (E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide?
The canonical SMILES for (E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide is O=C(/C=C/c1ccccc1F)Nc1ccc2ccccc2c1.
What is the InChIKey of (E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide?
The InChIKey is QMVRAWQBVZUVJV-ZRDIBKRKSA-N. The full InChI is InChI=1S/C19H14FNO/c20-18-8-4-3-6-15(18)10-12-19(22)21-17-11-9-14-5-1-2-7-16(14)13-17/h1-13H,(H,21,22)/b12-10+.
What are the key properties of (E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide?
(E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide has a molecular weight of 291.32 g/mol, XLogP of 4.63, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide is sourced from PubChem (CID 8762219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).