2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide

C14H25NO3 — CID 140911414

IUPAC2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide
SMILESCC(C)(C)C1(OCC(=O)NC2CC2)CCOCC1
InChIInChI=1S/C14H25NO3/c1-13(2,3)14(6-8-17-9-7-14)18-10-12(16)15-11-4-5-11/h11H,4-10H2,1-3H3,(H,15,16)
InChIKeyPKMLYZPHOWWRQH-UHFFFAOYSA-N
MW255.36 g/mol
LogP1.88
Rot. Bonds4

About 2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide

2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide (PubChem CID 140911414) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide
PubChem CID140911414
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC Name2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide
SMILESCC(C)(C)C1(OCC(=O)NC2CC2)CCOCC1
InChIInChI=1S/C14H25NO3/c1-13(2,3)14(6-8-17-9-7-14)18-10-12(16)15-11-4-5-11/h11H,4-10H2,1-3H3,(H,15,16)
InChIKeyPKMLYZPHOWWRQH-UHFFFAOYSA-N
XLogP1.88
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(aminomethyl)-4-methylcyclohexyl]oxy-N-cyclopropylacetamide
CID 65050836
3-amino-3-methyl-N-(oxan-4-yl)butanamide
CID 64684396
methyl 4-[2-(oxan-4-ylamino)-2-oxoethoxy]cyclohexane-1-carboxylate
CID 114450678
N-(oxan-4-yl)-2-[2-(propylamino)ethoxy]acetamide
CID 55182455
2-(3-methylazetidin-3-yl)oxy-N-[4-(2-methylbutan-2-yl)cyclohexyl]acetamide
CID 102610960
N,N'-dicyclopropyl-3,3-dimethylpentanediamide
CID 59002749
[2-(cyclopropylamino)-2-oxoethyl] hypofluorite
CID 89179896
2-(1-amino-2-methylpropan-2-yl)oxy-N-cyclopentylacetamide
CID 65053009
1-cyclopropyl-3-[(4-methyloxan-4-yl)methyl]urea
CID 103742048
N-(oxan-4-yl)-2-(oxan-4-ylmethylamino)acetamide
CID 63712370
N-cycloheptyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604811
2-(3-aminocyclopentyl)oxy-N-(oxan-4-yl)acetamide
CID 79465168

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide?
The IUPAC name of 2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide (CID 140911414) is 2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide.
What is the SMILES notation for 2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide?
The canonical SMILES for 2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide is CC(C)(C)C1(OCC(=O)NC2CC2)CCOCC1.
What is the InChIKey of 2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide?
The InChIKey is PKMLYZPHOWWRQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO3/c1-13(2,3)14(6-8-17-9-7-14)18-10-12(16)15-11-4-5-11/h11H,4-10H2,1-3H3,(H,15,16).
What are the key properties of 2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide?
2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide has a molecular weight of 255.36 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butyloxan-4-yl)oxy-N-cyclopropylacetamide is sourced from PubChem (CID 140911414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).