N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide

C20H32N2O2 — CID 25110485

IUPACN,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
SMILESCC(C)Cc1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1
InChIInChI=1S/C20H32N2O2/c1-15(2)13-18-14-19(21-24-18)20(23)22(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h14-17H,3-13H2,1-2H3
InChIKeyXBSYYNWVLYLNAE-UHFFFAOYSA-N
MW332.49 g/mol
LogP4.98
Rot. Bonds5

About N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide

N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide (PubChem CID 25110485) has the molecular formula C20H32N2O2 and a molecular weight of 332.49 g/mol. Its IUPAC name is N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
PubChem CID25110485
Molecular FormulaC20H32N2O2
Molecular Weight332.49 g/mol
Exact Mass332.25
IUPAC NameN,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
SMILESCC(C)Cc1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1
InChIInChI=1S/C20H32N2O2/c1-15(2)13-18-14-19(21-24-18)20(23)22(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h14-17H,3-13H2,1-2H3
InChIKeyXBSYYNWVLYLNAE-UHFFFAOYSA-N
XLogP4.98
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide (CID 25110485) is N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide is CC(C)Cc1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1.
What is the InChIKey of N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide?
The InChIKey is XBSYYNWVLYLNAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O2/c1-15(2)13-18-14-19(21-24-18)20(23)22(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h14-17H,3-13H2,1-2H3.
What are the key properties of N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide?
N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide has a molecular weight of 332.49 g/mol, XLogP of 4.98, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 25110485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).