2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide

C19H26N2O2 — CID 51096916

IUPAC2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide
SMILESO=C(C=C1CCCCC1)NCc1ccccc1N1CCOCC1
InChIInChI=1S/C19H26N2O2/c22-19(14-16-6-2-1-3-7-16)20-15-17-8-4-5-9-18(17)21-10-12-23-13-11-21/h4-5,8-9,14H,1-3,6-7,10-13,15H2,(H,20,22)
InChIKeyKQIKPZUBHWZOPL-UHFFFAOYSA-N
MW314.43 g/mol
LogP3.03
Rot. Bonds4

About 2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide

2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide (PubChem CID 51096916) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is 2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide
PubChem CID51096916
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC Name2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide
SMILESO=C(C=C1CCCCC1)NCc1ccccc1N1CCOCC1
InChIInChI=1S/C19H26N2O2/c22-19(14-16-6-2-1-3-7-16)20-15-17-8-4-5-9-18(17)21-10-12-23-13-11-21/h4-5,8-9,14H,1-3,6-7,10-13,15H2,(H,20,22)
InChIKeyKQIKPZUBHWZOPL-UHFFFAOYSA-N
XLogP3.03
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-amino-N-[(2-morpholin-4-ylphenyl)methyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119853786
2-methyl-N-[(2-morpholin-4-ylphenyl)methyl]propanamide
CID 47400471
1-amino-N-[(2-morpholin-4-ylphenyl)methyl]cyclopentane-1-carboxamide
CID 119853759
2,2,2-trifluoro-N-[(2-morpholin-4-ylphenyl)methyl]acetamide
CID 110443194
N-[(2-morpholin-4-ylphenyl)methyl]pyrrolidine-2-carboxamide
CID 119853783
N-[(2-morpholin-4-ylphenyl)methyl]morpholine-3-carboxamide
CID 119853743
N-[(2-morpholin-4-ylphenyl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110445215
N,N-dimethyl-3-[(2-morpholin-4-ylphenyl)methylamino]propanamide
CID 71933821
(E)-N-[(2-morpholin-4-ylphenyl)methyl]-3-(1H-pyrrolo[2,3-b]pyridin-3-yl)prop-2-enamide
CID 42636168
methyl 2-[2-[(2-morpholin-4-ylphenyl)methylamino]-2-oxoethyl]benzoate
CID 75440397
4-methoxy-N-[(2-morpholin-4-ylphenyl)methyl]piperidine-4-carboxamide;dihydrochloride
CID 119853784
N-[(2-morpholin-4-ylphenyl)methyl]-4-oxo-3H-quinazoline-2-carboxamide
CID 136579516

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide?
The IUPAC name of 2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide (CID 51096916) is 2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide.
What is the SMILES notation for 2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide?
The canonical SMILES for 2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide is O=C(C=C1CCCCC1)NCc1ccccc1N1CCOCC1.
What is the InChIKey of 2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide?
The InChIKey is KQIKPZUBHWZOPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c22-19(14-16-6-2-1-3-7-16)20-15-17-8-4-5-9-18(17)21-10-12-23-13-11-21/h4-5,8-9,14H,1-3,6-7,10-13,15H2,(H,20,22).
What are the key properties of 2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide?
2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide has a molecular weight of 314.43 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylidene-N-[(2-morpholin-4-ylphenyl)methyl]acetamide is sourced from PubChem (CID 51096916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).