N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide

C13H23NO2 — CID 58376090

IUPACN-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide
SMILESCCCN(C(=O)CC1CCOCC1)C1CC1
InChIInChI=1S/C13H23NO2/c1-2-7-14(12-3-4-12)13(15)10-11-5-8-16-9-6-11/h11-12H,2-10H2,1H3
InChIKeyDTUYFNWBLFYVLK-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.20
Rot. Bonds5

About N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide

N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide (PubChem CID 58376090) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide
PubChem CID58376090
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC NameN-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide
SMILESCCCN(C(=O)CC1CCOCC1)C1CC1
InChIInChI=1S/C13H23NO2/c1-2-7-14(12-3-4-12)13(15)10-11-5-8-16-9-6-11/h11-12H,2-10H2,1H3
InChIKeyDTUYFNWBLFYVLK-UHFFFAOYSA-N
XLogP2.20
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclopropyl[4-(dimethylamino)-4-(2-methoxyethyl)piperidino]methanone
CID 124045871
N-Methyl-N-[(oxan-4-YL)methyl]pentanamide
CID 91915004
2-Ethyl-1-[4-(2-methoxyethyl)piperidin-1-yl]butan-1-one
CID 53150825
1-[4-(2-Methoxyethyl)piperidin-1-YL]-4-methylpentan-1-one
CID 53150834
N-(2,2-difluorocyclopropyl)-2-(oxan-4-yl)-N-propylacetamide
CID 58376225
2-(oxan-4-yl)-N-propyl-N-(2,2,2-trifluoroethyl)acetamide
CID 58376679
N-cyclopropyl-2,2-difluoro-2-(oxan-4-yl)-N-propylacetamide
CID 58376681
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
2,2-difluoro-2-(oxan-4-yl)-N-propan-2-yl-N-propylacetamide
CID 144113092
2-(Oxan-4-yl)-1-piperidin-1-ylethanone
CID 17920591
1-[4-(2-Methoxyethyl)piperidin-1-YL]butan-1-one
CID 53150884

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide?
The IUPAC name of N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide (CID 58376090) is N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide.
What is the SMILES notation for N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide?
The canonical SMILES for N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide is CCCN(C(=O)CC1CCOCC1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide?
The InChIKey is DTUYFNWBLFYVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-2-7-14(12-3-4-12)13(15)10-11-5-8-16-9-6-11/h11-12H,2-10H2,1H3.
What are the key properties of N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide?
N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide has a molecular weight of 225.33 g/mol, XLogP of 2.20, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(oxan-4-yl)-N-propylacetamide is sourced from PubChem (CID 58376090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).