N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide

C21H32N2O2 — CID 56955982

IUPACN,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide
SMILESO=C(c1cc(C2CCCC2)on1)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H32N2O2/c24-21(19-15-20(25-22-19)16-9-7-8-10-16)23(17-11-3-1-4-12-17)18-13-5-2-6-14-18/h15-18H,1-14H2
InChIKeyIKKTXVDCGJIDIH-UHFFFAOYSA-N
MW344.50 g/mol
LogP5.44
Rot. Bonds4

About N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide

N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide (PubChem CID 56955982) has the molecular formula C21H32N2O2 and a molecular weight of 344.50 g/mol. Its IUPAC name is N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide
PubChem CID56955982
Molecular FormulaC21H32N2O2
Molecular Weight344.50 g/mol
Exact Mass344.25
IUPAC NameN,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide
SMILESO=C(c1cc(C2CCCC2)on1)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H32N2O2/c24-21(19-15-20(25-22-19)16-9-7-8-10-16)23(17-11-3-1-4-12-17)18-13-5-2-6-14-18/h15-18H,1-14H2
InChIKeyIKKTXVDCGJIDIH-UHFFFAOYSA-N
XLogP5.44
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.50
LogP ≤ 55.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Cym-5541
CID 17253208
N,N-dicyclohexyl-5-propyl-3-isoxazolecarboxamide
CID 5309153
N-cyclohexyl-N,5-dimethyl-3-isoxazolecarboxamide
CID 2814457
N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide
CID 3158158
N-cyclohexyl-N-methyl-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
CID 1093791
N-cyclohexyl-5-propyl-3-isoxazolecarboxamide
CID 5307570
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
N,N-dicyclohexyl-5-isopropyl-3-isoxazolecarboxamide
CID 17253281
N,N-dicyclohexyl-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 25110485
N,N-dicyclohexyl-5-phenyl-1,2-oxazole-3-carboxamide
CID 25110488

Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide (CID 56955982) is N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide is O=C(c1cc(C2CCCC2)on1)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide?
The InChIKey is IKKTXVDCGJIDIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32N2O2/c24-21(19-15-20(25-22-19)16-9-7-8-10-16)23(17-11-3-1-4-12-17)18-13-5-2-6-14-18/h15-18H,1-14H2.
What are the key properties of N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide?
N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide has a molecular weight of 344.50 g/mol, XLogP of 5.44, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-5-cyclopentyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 56955982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).