N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide

C13H23NO2 — CID 71244447

IUPACN-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide
SMILESCN(C(=O)C[C@H]1CCOC1)C1(C)CC1(C)C
InChIInChI=1S/C13H23NO2/c1-12(2)9-13(12,3)14(4)11(15)7-10-5-6-16-8-10/h10H,5-9H2,1-4H3/t10-,13?/m1/s1
InChIKeyUMFZHKWKVSSNMZ-VUUHIHSGSA-N
MW225.33 g/mol
LogP2.06
Rot. Bonds3

About N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide

N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide (PubChem CID 71244447) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide.

Molecular Properties

Compound NameN-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide
PubChem CID71244447
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC NameN-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide
SMILESCN(C(=O)C[C@H]1CCOC1)C1(C)CC1(C)C
InChIInChI=1S/C13H23NO2/c1-12(2)9-13(12,3)14(4)11(15)7-10-5-6-16-8-10/h10H,5-9H2,1-4H3/t10-,13?/m1/s1
InChIKeyUMFZHKWKVSSNMZ-VUUHIHSGSA-N
XLogP2.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide?
The IUPAC name of N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide (CID 71244447) is N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide.
What is the SMILES notation for N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide?
The canonical SMILES for N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide is CN(C(=O)C[C@H]1CCOC1)C1(C)CC1(C)C.
What is the InChIKey of N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide?
The InChIKey is UMFZHKWKVSSNMZ-VUUHIHSGSA-N. The full InChI is InChI=1S/C13H23NO2/c1-12(2)9-13(12,3)14(4)11(15)7-10-5-6-16-8-10/h10H,5-9H2,1-4H3/t10-,13?/m1/s1.
What are the key properties of N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide?
N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide has a molecular weight of 225.33 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(3R)-oxolan-3-yl]-N-(1,2,2-trimethylcyclopropyl)acetamide is sourced from PubChem (CID 71244447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).