(Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide

C18H20N2O3 — CID 97456575

IUPAC(Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide
SMILESO=C(/C=C\c1ccco1)Nc1cccc(CN2CCOCC2)c1
InChIInChI=1S/C18H20N2O3/c21-18(7-6-17-5-2-10-23-17)19-16-4-1-3-15(13-16)14-20-8-11-22-12-9-20/h1-7,10,13H,8-9,11-12,14H2,(H,19,21)/b7-6-
InChIKeyLFSJLIVKXOPLOB-SREVYHEPSA-N
MW312.37 g/mol
LogP2.76
Rot. Bonds5

About (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide

(Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide (PubChem CID 97456575) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide.

Molecular Properties

Compound Name(Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide
PubChem CID97456575
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name(Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide
SMILESO=C(/C=C\c1ccco1)Nc1cccc(CN2CCOCC2)c1
InChIInChI=1S/C18H20N2O3/c21-18(7-6-17-5-2-10-23-17)19-16-4-1-3-15(13-16)14-20-8-11-22-12-9-20/h1-7,10,13H,8-9,11-12,14H2,(H,19,21)/b7-6-
InChIKeyLFSJLIVKXOPLOB-SREVYHEPSA-N
XLogP2.76
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide with MolForge

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Related Compounds

3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid
CID 748204
(E)-3-(furan-2-yl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]prop-2-enamide
CID 51072840
(E)-N-(3-bromophenyl)-3-(furan-2-yl)prop-2-enamide
CID 963809
(Z)-3-(5-methylfuran-2-yl)-N-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]prop-2-enamide
CID 94662482
3-(furan-2-yl)-N-phenylprop-2-enamide
CID 578025
3-(furan-2-yl)-N-(4-morpholin-4-ylbut-2-ynyl)prop-2-enamide
CID 91939208
(E)-3-(furan-2-yl)-N-[[3-(hydroxymethyl)phenyl]carbamothioyl]prop-2-enamide
CID 916644
3-(furan-2-yl)-N-[3-(trifluoromethyl)phenyl]prop-2-enamide
CID 1489531
tert-butyl N-[[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]phenyl]methyl]-N-methylcarbamate
CID 94161008
(E)-N-[4-(morpholin-4-ylmethyl)phenyl]-3-phenylprop-2-enamide
CID 950916
[3-(morpholin-4-ylmethyl)phenyl]thiourea
CID 97033783
(E)-3-phenyl-N-[3-(thiomorpholin-4-ylmethyl)phenyl]prop-2-enamide
CID 10830868

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide?
The IUPAC name of (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide (CID 97456575) is (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide.
What is the SMILES notation for (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide?
The canonical SMILES for (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide is O=C(/C=C\c1ccco1)Nc1cccc(CN2CCOCC2)c1.
What is the InChIKey of (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide?
The InChIKey is LFSJLIVKXOPLOB-SREVYHEPSA-N. The full InChI is InChI=1S/C18H20N2O3/c21-18(7-6-17-5-2-10-23-17)19-16-4-1-3-15(13-16)14-20-8-11-22-12-9-20/h1-7,10,13H,8-9,11-12,14H2,(H,19,21)/b7-6-.
What are the key properties of (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide?
(Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide has a molecular weight of 312.37 g/mol, XLogP of 2.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(furan-2-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]prop-2-enamide is sourced from PubChem (CID 97456575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).