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

C13H21NO2 — CID 58376750

IUPACN-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide
SMILESCCCN(C(=O)CC12COCC1C2)C1CC1
InChIInChI=1S/C13H21NO2/c1-2-5-14(11-3-4-11)12(15)7-13-6-10(13)8-16-9-13/h10-11H,2-9H2,1H3
InChIKeyHEIAVZYXUNYFQJ-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.81
Rot. Bonds5

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

N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide (PubChem CID 58376750) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide
PubChem CID58376750
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC NameN-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide
SMILESCCCN(C(=O)CC12COCC1C2)C1CC1
InChIInChI=1S/C13H21NO2/c1-2-5-14(11-3-4-11)12(15)7-13-6-10(13)8-16-9-13/h10-11H,2-9H2,1H3
InChIKeyHEIAVZYXUNYFQJ-UHFFFAOYSA-N
XLogP1.81
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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-(6,6-dimethyl-3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide
CID 58375894
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
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-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide?
The IUPAC name of N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide (CID 58376750) is N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide.
What is the SMILES notation for N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide?
The canonical SMILES for N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide is CCCN(C(=O)CC12COCC1C2)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide?
The InChIKey is HEIAVZYXUNYFQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-2-5-14(11-3-4-11)12(15)7-13-6-10(13)8-16-9-13/h10-11H,2-9H2,1H3.
What are the key properties of N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide?
N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide has a molecular weight of 223.32 g/mol, XLogP of 1.81, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(3-oxabicyclo[3.1.0]hexan-1-yl)-N-propylacetamide is sourced from PubChem (CID 58376750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).