3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide

C14H18N2O3 — CID 5104066

IUPAC3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide
SMILESCOc1ccc(C=CC(=O)NN2CCOCC2)cc1
InChIInChI=1S/C14H18N2O3/c1-18-13-5-2-12(3-6-13)4-7-14(17)15-16-8-10-19-11-9-16/h2-7H,8-11H2,1H3,(H,15,17)
InChIKeyMYKNHGXCKMIFQN-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.07
Rot. Bonds4

About 3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide

3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide (PubChem CID 5104066) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide
PubChem CID5104066
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide
SMILESCOc1ccc(C=CC(=O)NN2CCOCC2)cc1
InChIInChI=1S/C14H18N2O3/c1-18-13-5-2-12(3-6-13)4-7-14(17)15-16-8-10-19-11-9-16/h2-7H,8-11H2,1H3,(H,15,17)
InChIKeyMYKNHGXCKMIFQN-UHFFFAOYSA-N
XLogP1.07
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(E)-3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide
CID 6271180
(E)-3-(4-bromophenyl)-N-morpholin-4-ylprop-2-enamide
CID 903165
(E)-3-(4-methoxyphenyl)-N-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]prop-2-enamide
CID 102270516
(E)-3-(4-methoxyphenyl)-N'-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]prop-2-enehydrazide
CID 21406103
3-(4-methoxyphenyl)-N-[(4-morpholin-4-ylphenyl)carbamothioyl]prop-2-enamide
CID 3468232
(E)-3-(4-methoxyphenyl)-N-[3-(morpholine-4-carbonyl)phenyl]prop-2-enamide
CID 17205470
(E)-1-(6-methoxynaphthalen-2-yl)-3-(4-morpholin-4-ylphenyl)prop-2-en-1-one
CID 7947303
3-(4-methoxyphenyl)-N-[2-[3-(4-methoxyphenyl)prop-2-enoylamino]ethyl]prop-2-enamide
CID 2933087
(E)-N-(morpholin-4-ylcarbamothioyl)-3-(4-propan-2-ylphenyl)prop-2-enamide
CID 840359
(E)-N-cyclopropyl-3-(4-methoxyphenyl)prop-2-enamide
CID 874267
N-morpholin-4-yl-3-thiophen-2-ylprop-2-enamide
CID 903687
2-[3-(4-methoxyphenyl)prop-2-enoylamino]-3-methylbutanoic acid
CID 4875063

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide (CID 5104066) is 3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide is COc1ccc(C=CC(=O)NN2CCOCC2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide?
The InChIKey is MYKNHGXCKMIFQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-18-13-5-2-12(3-6-13)4-7-14(17)15-16-8-10-19-11-9-16/h2-7H,8-11H2,1H3,(H,15,17).
What are the key properties of 3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide?
3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide has a molecular weight of 262.31 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-morpholin-4-ylprop-2-enamide is sourced from PubChem (CID 5104066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).