(E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide

C17H17NO2 — CID 137465399

IUPAC(E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide
SMILESO=C(/C=C/C1CCCO1)Nc1ccc2ccccc2c1
InChIInChI=1S/C17H17NO2/c19-17(10-9-16-6-3-11-20-16)18-15-8-7-13-4-1-2-5-14(13)12-15/h1-2,4-5,7-10,12,16H,3,6,11H2,(H,18,19)/b10-9+
InChIKeyMWNRZFZRNNABFQ-MDZDMXLPSA-N
MW267.33 g/mol
LogP3.51
Rot. Bonds3

About (E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide

(E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide (PubChem CID 137465399) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is (E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide.

Molecular Properties

Compound Name(E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide
PubChem CID137465399
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name(E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide
SMILESO=C(/C=C/C1CCCO1)Nc1ccc2ccccc2c1
InChIInChI=1S/C17H17NO2/c19-17(10-9-16-6-3-11-20-16)18-15-8-7-13-4-1-2-5-14(13)12-15/h1-2,4-5,7-10,12,16H,3,6,11H2,(H,18,19)/b10-9+
InChIKeyMWNRZFZRNNABFQ-MDZDMXLPSA-N
XLogP3.51
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.51
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

(E)-N-[3-(2,3-dihydro-1,3-benzoxazol-2-yl)phenyl]-3-(oxolan-2-yl)prop-2-enamide
CID 137465400
4-(naphthalen-2-ylamino)-4-oxobut-2-enoic acid
CID 740391
1-(naphthalen-2-ylcarbamothioylamino)-3-[[(2R)-oxolan-2-yl]methyl]urea
CID 97018071
(E)-3-(2-fluorophenyl)-N-naphthalen-2-ylprop-2-enamide
CID 8762219
1-[(E)-2-cyclopropylethenyl]-3-naphthalen-2-ylurea
CID 108915883
(E)-3-(5-methylfuran-2-yl)-N-naphthalen-2-ylprop-2-enamide
CID 2146457
N-naphthalen-2-yl-3-thiophen-2-ylprop-2-enamide
CID 3594199
(1S,2R,3S,4S)-3-(naphthalen-2-ylcarbamoyl)bicyclo[2.2.1]heptane-2-carboxylic acid
CID 100821052
(E)-3-(4-tert-butylphenyl)-N-naphthalen-2-ylprop-2-enamide
CID 6273647
2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide
CID 9295169
N-naphthalen-2-yl-2-[3-(oxolan-2-ylmethoxy)anilino]acetamide
CID 54828752
2-bromo-N-naphthalen-2-yl-5-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
CID 25362129

Frequently Asked Questions

What is the IUPAC name of (E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide?
The IUPAC name of (E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide (CID 137465399) is (E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide.
What is the SMILES notation for (E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide?
The canonical SMILES for (E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide is O=C(/C=C/C1CCCO1)Nc1ccc2ccccc2c1.
What is the InChIKey of (E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide?
The InChIKey is MWNRZFZRNNABFQ-MDZDMXLPSA-N. The full InChI is InChI=1S/C17H17NO2/c19-17(10-9-16-6-3-11-20-16)18-15-8-7-13-4-1-2-5-14(13)12-15/h1-2,4-5,7-10,12,16H,3,6,11H2,(H,18,19)/b10-9+.
What are the key properties of (E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide?
(E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide has a molecular weight of 267.33 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-naphthalen-2-yl-3-(oxolan-2-yl)prop-2-enamide is sourced from PubChem (CID 137465399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).