N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide

C15H27NO2 — CID 58376643

IUPACN-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide
SMILESCCCN(C(=O)CC1CC(C)OC(C)C1)C1CC1
InChIInChI=1S/C15H27NO2/c1-4-7-16(14-5-6-14)15(17)10-13-8-11(2)18-12(3)9-13/h11-14H,4-10H2,1-3H3
InChIKeyIHUADCLKFHEGES-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.98
Rot. Bonds5

About N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide

N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide (PubChem CID 58376643) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide
PubChem CID58376643
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC NameN-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide
SMILESCCCN(C(=O)CC1CC(C)OC(C)C1)C1CC1
InChIInChI=1S/C15H27NO2/c1-4-7-16(14-5-6-14)15(17)10-13-8-11(2)18-12(3)9-13/h11-14H,4-10H2,1-3H3
InChIKeyIHUADCLKFHEGES-UHFFFAOYSA-N
XLogP2.98
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,6-dimethyloxan-4-yl)-N-propyl-N-(2,2,2-trifluoroethyl)acetamide
CID 58376243
2-(2,6-dimethyloxan-4-yl)-N-(2-fluorocyclopropyl)-N-propylacetamide
CID 58376637
2-(2,6-dimethyloxan-4-yl)-N-(3-fluorobutan-2-yl)-N-propylacetamide
CID 70191357
N-(3-fluorobutan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide
CID 70191681
N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide
CID 143821240
N-tert-butyl-N-ethyl-4-methoxycyclohexane-1-carboxamide
CID 58033848
N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide
CID 58376090
N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide
CID 58376235
N-cyclopropyl-2-methyl-2-(oxan-4-yl)-N-propylpropanamide
CID 58376449
N-cyclopropyl-2-(3-methoxycyclopentyl)-N-propylacetamide
CID 58376465
N-cyclopropyl-2-(4-methoxycyclohexyl)-N-propylacetamide
CID 58376568
N-cyclopropyl-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide
CID 58376686

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide?
The IUPAC name of N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide (CID 58376643) is N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide.
What is the SMILES notation for N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide?
The canonical SMILES for N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide is CCCN(C(=O)CC1CC(C)OC(C)C1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide?
The InChIKey is IHUADCLKFHEGES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-4-7-16(14-5-6-14)15(17)10-13-8-11(2)18-12(3)9-13/h11-14H,4-10H2,1-3H3.
What are the key properties of N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide?
N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide has a molecular weight of 253.39 g/mol, XLogP of 2.98, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2,6-dimethyloxan-4-yl)-N-propylacetamide is sourced from PubChem (CID 58376643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).