2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide

C12H23NO2 — CID 142563332

IUPAC2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)C[C@H]1CCOC1
InChIInChI=1S/C12H23NO2/c1-3-6-13(7-4-2)12(14)9-11-5-8-15-10-11/h11H,3-10H2,1-2H3/t11-/m1/s1
InChIKeyRYWSUKUSIYIAEX-LLVKDONJSA-N
MW213.32 g/mol
LogP2.06
Rot. Bonds6

About 2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide

2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide (PubChem CID 142563332) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide
PubChem CID142563332
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)C[C@H]1CCOC1
InChIInChI=1S/C12H23NO2/c1-3-6-13(7-4-2)12(14)9-11-5-8-15-10-11/h11H,3-10H2,1-2H3/t11-/m1/s1
InChIKeyRYWSUKUSIYIAEX-LLVKDONJSA-N
XLogP2.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide?
The IUPAC name of 2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide (CID 142563332) is 2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide?
The canonical SMILES for 2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide is CCCN(CCC)C(=O)C[C@H]1CCOC1.
What is the InChIKey of 2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide?
The InChIKey is RYWSUKUSIYIAEX-LLVKDONJSA-N. The full InChI is InChI=1S/C12H23NO2/c1-3-6-13(7-4-2)12(14)9-11-5-8-15-10-11/h11H,3-10H2,1-2H3/t11-/m1/s1.
What are the key properties of 2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide?
2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide has a molecular weight of 213.32 g/mol, XLogP of 2.06, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-oxolan-3-yl]-N,N-dipropylacetamide is sourced from PubChem (CID 142563332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).