5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide

C19H28N2O3 — CID 25110501

IUPAC5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide
SMILESCC1CCCCC1N(C(=O)c1cc(C2CC2)on1)C1CCOCC1
InChIInChI=1S/C19H28N2O3/c1-13-4-2-3-5-17(13)21(15-8-10-23-11-9-15)19(22)16-12-18(24-20-16)14-6-7-14/h12-15,17H,2-11H2,1H3
InChIKeyGRIJGLMNIRAJPK-UHFFFAOYSA-N
MW332.44 g/mol
LogP3.75
Rot. Bonds4

About 5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide

5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide (PubChem CID 25110501) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is 5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide
PubChem CID25110501
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC Name5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide
SMILESCC1CCCCC1N(C(=O)c1cc(C2CC2)on1)C1CCOCC1
InChIInChI=1S/C19H28N2O3/c1-13-4-2-3-5-17(13)21(15-8-10-23-11-9-15)19(22)16-12-18(24-20-16)14-6-7-14/h12-15,17H,2-11H2,1H3
InChIKeyGRIJGLMNIRAJPK-UHFFFAOYSA-N
XLogP3.75
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Cym-5541
CID 17253208
N-cyclohexyl-N,5-dimethyl-3-isoxazolecarboxamide
CID 2814457
N-cyclohexyl-5-propyl-3-isoxazolecarboxamide
CID 5307570
N,N-dicyclohexyl-5-propyl-3-isoxazolecarboxamide
CID 5309153
N-cyclohexyl-5-cyclopropylisoxazole-3-carboxamide
CID 16188020
N,N-dicyclohexyl-5-methylisoxazole-3-carboxamide
CID 3245758
N-(Butan-2-YL)-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 5307751
5-(2-methylpropyl)-N-(2-morpholin-4-ylethyl)-1,2-oxazole-3-carboxamide
CID 5307969
5-(2-methylpropyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide
CID 5308762
N,N-dicyclohexyl[5-(methylethyl)isoxazol-3-yl]carboxamide
CID 17253281
N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 25110485
5-cyclopropyl-N,N-bis(2-methylcyclohexyl)-1,2-oxazole-3-carboxamide
CID 25110496

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide (CID 25110501) is 5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide is CC1CCCCC1N(C(=O)c1cc(C2CC2)on1)C1CCOCC1.
What is the InChIKey of 5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is GRIJGLMNIRAJPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-13-4-2-3-5-17(13)21(15-8-10-23-11-9-15)19(22)16-12-18(24-20-16)14-6-7-14/h12-15,17H,2-11H2,1H3.
What are the key properties of 5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide?
5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 332.44 g/mol, XLogP of 3.75, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(2-methylcyclohexyl)-N-(oxan-4-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 25110501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).