N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide

C18H24N2O2 — CID 2294960

IUPACN-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide
SMILESO=C(NCCC1=CCCCC1)C(=O)NCCc1ccccc1
InChIInChI=1S/C18H24N2O2/c21-17(19-13-11-15-7-3-1-4-8-15)18(22)20-14-12-16-9-5-2-6-10-16/h1,3-4,7-9H,2,5-6,10-14H2,(H,19,21)(H,20,22)
InChIKeyDVYYWHCGUPCARJ-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.35
Rot. Bonds6

About N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide

N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide (PubChem CID 2294960) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide.

Molecular Properties

Compound NameN-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide
PubChem CID2294960
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC NameN-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide
SMILESO=C(NCCC1=CCCCC1)C(=O)NCCc1ccccc1
InChIInChI=1S/C18H24N2O2/c21-17(19-13-11-15-7-3-1-4-8-15)18(22)20-14-12-16-9-5-2-6-10-16/h1,3-4,7-9H,2,5-6,10-14H2,(H,19,21)(H,20,22)
InChIKeyDVYYWHCGUPCARJ-UHFFFAOYSA-N
XLogP2.35
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(cyclohexen-1-yl)ethyl]-N'-[2-(4-methoxyphenyl)ethyl]oxamide
CID 44998295
N'-benzyl-N-[2-(cyclohexen-1-yl)ethyl]propanediamide
CID 108942883
N-[2-(cyclohexen-1-yl)ethyl]-2-(3-phenylpropylamino)acetamide
CID 108993941
N-[2-(cyclohexen-1-yl)ethyl]-3-(3-phenylpropylamino)propanamide
CID 109014685
2-[2-(cyclohexen-1-yl)ethylamino]-N-(2-phenylethyl)pyrimidine-5-carboxamide
CID 109251184
N'-[2-(cyclohexen-1-yl)ethyl]-N-[3-[4-(dimethylamino)phenyl]propyl]oxamide
CID 16891997
N-[2-(cyclohexen-1-yl)ethylcarbamothioyl]benzamide
CID 909201
6-[2-(cyclohexen-1-yl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109152709
N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-hydroxy-2-naphthalen-1-ylethyl)oxamide
CID 56764165
N'-tert-butyl-N-[2-(cyclohexen-1-yl)ethyl]oxamide
CID 2914644
N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-methoxyethyl)oxamide
CID 2289204
N-[2-(cyclohexen-1-yl)ethyl]-2-phenylpropanamide
CID 71304909

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide?
The IUPAC name of N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide (CID 2294960) is N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide.
What is the SMILES notation for N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide?
The canonical SMILES for N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide is O=C(NCCC1=CCCCC1)C(=O)NCCc1ccccc1.
What is the InChIKey of N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide?
The InChIKey is DVYYWHCGUPCARJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c21-17(19-13-11-15-7-3-1-4-8-15)18(22)20-14-12-16-9-5-2-6-10-16/h1,3-4,7-9H,2,5-6,10-14H2,(H,19,21)(H,20,22).
What are the key properties of N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide?
N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide has a molecular weight of 300.40 g/mol, XLogP of 2.35, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexen-1-yl)ethyl]-N'-(2-phenylethyl)oxamide is sourced from PubChem (CID 2294960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).