2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide

C11H23NO2 — CID 103028775

IUPAC2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide
SMILESCCC(CC)N(C)C(=O)C(C)(C)OC
InChIInChI=1S/C11H23NO2/c1-7-9(8-2)12(5)10(13)11(3,4)14-6/h9H,7-8H2,1-6H3
InChIKeyVBQAQCKXNPNPDX-UHFFFAOYSA-N
MW201.31 g/mol
LogP2.06
Rot. Bonds5

About 2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide

2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide (PubChem CID 103028775) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide.

Molecular Properties

Compound Name2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide
PubChem CID103028775
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide
SMILESCCC(CC)N(C)C(=O)C(C)(C)OC
InChIInChI=1S/C11H23NO2/c1-7-9(8-2)12(5)10(13)11(3,4)14-6/h9H,7-8H2,1-6H3
InChIKeyVBQAQCKXNPNPDX-UHFFFAOYSA-N
XLogP2.06
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
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-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide?
The IUPAC name of 2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide (CID 103028775) is 2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide.
What is the SMILES notation for 2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide?
The canonical SMILES for 2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide is CCC(CC)N(C)C(=O)C(C)(C)OC.
What is the InChIKey of 2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide?
The InChIKey is VBQAQCKXNPNPDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-7-9(8-2)12(5)10(13)11(3,4)14-6/h9H,7-8H2,1-6H3.
What are the key properties of 2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide?
2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide has a molecular weight of 201.31 g/mol, XLogP of 2.06, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,2-dimethyl-N-pentan-3-ylpropanamide is sourced from PubChem (CID 103028775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).