N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide

C15H25NO2 — CID 58375894

IUPACN-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide
SMILESCCCN(C(=O)CC12COCC1C2(C)C)C1CC1
InChIInChI=1S/C15H25NO2/c1-4-7-16(11-5-6-11)13(17)8-15-10-18-9-12(15)14(15,2)3/h11-12H,4-10H2,1-3H3
InChIKeyLHSLQIDMPFZVEM-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.45
Rot. Bonds5

About N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide

N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide (PubChem CID 58375894) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide
PubChem CID58375894
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC NameN-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide
SMILESCCCN(C(=O)CC12COCC1C2(C)C)C1CC1
InChIInChI=1S/C15H25NO2/c1-4-7-16(11-5-6-11)13(17)8-15-10-18-9-12(15)14(15,2)3/h11-12H,4-10H2,1-3H3
InChIKeyLHSLQIDMPFZVEM-UHFFFAOYSA-N
XLogP2.45
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S,2R)-2-cyclopropylcyclopropyl]-(8-oxa-2-azaspiro[4.5]decan-2-yl)methanone
CID 128503941
N-(2-fluorocyclopropyl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide
CID 58376742
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-cyclopropyl-2-(4-propan-2-yloxan-4-yl)-N-propylacetamide
CID 58376446
N-cyclopropyl-2-methyl-2-(oxan-4-yl)-N-propylpropanamide
CID 58376449
N-cyclopropyl-2-(4-propan-2-yloxolan-3-yl)-N-propylacetamide
CID 58376633
N-cyclopropyl-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide
CID 58376686
N-cyclopropyl-1-(oxan-4-yl)-N-propylcyclopropane-1-carboxamide
CID 58376741
N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide
CID 58376750
2,6-Di(propan-2-yl)-9-oxa-2-azaspiro[4.5]decan-1-one
CID 66804096
N-cyclopropyl-2-(4-ethyl-3-methyloxan-4-yl)-N-propylacetamide
CID 70189282

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide?
The IUPAC name of N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide (CID 58375894) is N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide.
What is the SMILES notation for N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide?
The canonical SMILES for N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide is CCCN(C(=O)CC12COCC1C2(C)C)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide?
The InChIKey is LHSLQIDMPFZVEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-4-7-16(11-5-6-11)13(17)8-15-10-18-9-12(15)14(15,2)3/h11-12H,4-10H2,1-3H3.
What are the key properties of N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide?
N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide has a molecular weight of 251.37 g/mol, XLogP of 2.45, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide is sourced from PubChem (CID 58375894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).