3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide

C16H26N2O2 — CID 154739445

IUPAC3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide
SMILESCc1noc(C)c1C(C)CC(=O)NC1(C)CCCCC1
InChIInChI=1S/C16H26N2O2/c1-11(15-12(2)18-20-13(15)3)10-14(19)17-16(4)8-6-5-7-9-16/h11H,5-10H2,1-4H3,(H,17,19)
InChIKeyQNWFQEHRFRYCMT-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.62
Rot. Bonds4

About 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide

3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide (PubChem CID 154739445) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide.

Molecular Properties

Compound Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide
PubChem CID154739445
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide
SMILESCc1noc(C)c1C(C)CC(=O)NC1(C)CCCCC1
InChIInChI=1S/C16H26N2O2/c1-11(15-12(2)18-20-13(15)3)10-14(19)17-16(4)8-6-5-7-9-16/h11H,5-10H2,1-4H3,(H,17,19)
InChIKeyQNWFQEHRFRYCMT-UHFFFAOYSA-N
XLogP3.62
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[3-(3,5-dimethyl-1,2-oxazol-4-yl)butanoylamino]methyl]cyclohexane-1-carboxylic acid
CID 120545063
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2,2,6,6-tetramethylmorpholin-4-yl)butan-1-one
CID 136534661
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-hydroxypropyl)butanamide
CID 109378471
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-hydroxy-2-methylpropan-2-yl)butanamide
CID 110000893
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(1-hydroxycycloheptyl)methyl]propanamide
CID 111428719
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-hydroxy-2,3-dimethylbutyl)butanamide
CID 109379753
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-ethyl-2-hydroxybutyl)butanamide
CID 109379728
2-(1-aminocyclopentyl)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]acetamide
CID 79236390
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-hydroxy-3-methylpentyl)butanamide
CID 109380177
(3S)-N-(3-cyclohexyl-1-methylpyrazol-5-yl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)butanamide
CID 99713793
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-(propan-2-ylamino)propanamide
CID 79236273
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(3-methoxy-6-methyl-2-pyridinyl)butanamide
CID 138993062

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide?
The IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide (CID 154739445) is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide.
What is the SMILES notation for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide?
The canonical SMILES for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide is Cc1noc(C)c1C(C)CC(=O)NC1(C)CCCCC1.
What is the InChIKey of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide?
The InChIKey is QNWFQEHRFRYCMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-11(15-12(2)18-20-13(15)3)10-14(19)17-16(4)8-6-5-7-9-16/h11H,5-10H2,1-4H3,(H,17,19).
What are the key properties of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide?
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide has a molecular weight of 278.40 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(1-methylcyclohexyl)butanamide is sourced from PubChem (CID 154739445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).