N-prop-2-enoxynaphthalene-1-carboxamide

C14H13NO2 — CID 71365701

IUPACN-prop-2-enoxynaphthalene-1-carboxamide
SMILESC=CCONC(=O)c1cccc2ccccc12
InChIInChI=1S/C14H13NO2/c1-2-10-17-15-14(16)13-9-5-7-11-6-3-4-8-12(11)13/h2-9H,1,10H2,(H,15,16)
InChIKeyFSUDXMQKRVOCDS-UHFFFAOYSA-N
MW227.26 g/mol
LogP2.69
Rot. Bonds4

About N-prop-2-enoxynaphthalene-1-carboxamide

N-prop-2-enoxynaphthalene-1-carboxamide (PubChem CID 71365701) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is N-prop-2-enoxynaphthalene-1-carboxamide.

Molecular Properties

Compound NameN-prop-2-enoxynaphthalene-1-carboxamide
PubChem CID71365701
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC NameN-prop-2-enoxynaphthalene-1-carboxamide
SMILESC=CCONC(=O)c1cccc2ccccc12
InChIInChI=1S/C14H13NO2/c1-2-10-17-15-14(16)13-9-5-7-11-6-3-4-8-12(11)13/h2-9H,1,10H2,(H,15,16)
InChIKeyFSUDXMQKRVOCDS-UHFFFAOYSA-N
XLogP2.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-naphthalen-1-yl-3-prop-2-enoxyurea
CID 4604383
1-naphthalen-1-ylbut-3-en-1-one
CID 11030731
2-sulfanylideneethyl 2-naphthalen-1-ylprop-2-enoate
CID 90865216
N-[2-(prop-2-enylcarbamoyl)phenyl]naphthalene-1-carboxamide
CID 2174448
(naphthalene-1-carbonylamino) trifluoromethanesulfonate
CID 87389546
N-(2-amino-2-oxoethyl)naphthalene-1-carboxamide
CID 4059241
N-[11-(naphthalene-1-carbonylamino)undecyl]naphthalene-1-carboxamide
CID 137492009
N-(2-amino-1-phenylethyl)naphthalene-1-carboxamide
CID 10424319
methyl 2-(naphthalene-1-carbonylamino)acetate
CID 19789843
N-(2-methylprop-2-enoyl)naphthalene-1-carboxamide
CID 22320844
2-[[2-(2-prop-2-enoyloxyethoxycarbamoyl)benzoyl]amino]oxyethyl prop-2-enoate
CID 88525710
CID 129133768
CID 129133768

Frequently Asked Questions

What is the IUPAC name of N-prop-2-enoxynaphthalene-1-carboxamide?
The IUPAC name of N-prop-2-enoxynaphthalene-1-carboxamide (CID 71365701) is N-prop-2-enoxynaphthalene-1-carboxamide.
What is the SMILES notation for N-prop-2-enoxynaphthalene-1-carboxamide?
The canonical SMILES for N-prop-2-enoxynaphthalene-1-carboxamide is C=CCONC(=O)c1cccc2ccccc12.
What is the InChIKey of N-prop-2-enoxynaphthalene-1-carboxamide?
The InChIKey is FSUDXMQKRVOCDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c1-2-10-17-15-14(16)13-9-5-7-11-6-3-4-8-12(11)13/h2-9H,1,10H2,(H,15,16).
What are the key properties of N-prop-2-enoxynaphthalene-1-carboxamide?
N-prop-2-enoxynaphthalene-1-carboxamide has a molecular weight of 227.26 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enoxynaphthalene-1-carboxamide is sourced from PubChem (CID 71365701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).