2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide

C16H34N2O4 — CID 169160521

IUPAC2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide
SMILESCCC(OC)C(=O)NC(C)C.CCOC(C)C(=O)NC(C)C
InChIInChI=1S/2C8H17NO2/c1-5-7(11-4)8(10)9-6(2)3;1-5-11-7(4)8(10)9-6(2)3/h2*6-7H,5H2,1-4H3,(H,9,10)
InChIKeyTXVSQHZIURBQKE-UHFFFAOYSA-N
MW318.46 g/mol
LogP1.87
Rot. Bonds8

About 2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide

2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide (PubChem CID 169160521) has the molecular formula C16H34N2O4 and a molecular weight of 318.46 g/mol. Its IUPAC name is 2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide.

Molecular Properties

Compound Name2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide
PubChem CID169160521
Molecular FormulaC16H34N2O4
Molecular Weight318.46 g/mol
Exact Mass318.25
IUPAC Name2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide
SMILESCCC(OC)C(=O)NC(C)C.CCOC(C)C(=O)NC(C)C
InChIInChI=1S/2C8H17NO2/c1-5-7(11-4)8(10)9-6(2)3;1-5-11-7(4)8(10)9-6(2)3/h2*6-7H,5H2,1-4H3,(H,9,10)
InChIKeyTXVSQHZIURBQKE-UHFFFAOYSA-N
XLogP1.87
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide?
The IUPAC name of 2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide (CID 169160521) is 2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide.
What is the SMILES notation for 2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide?
The canonical SMILES for 2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide is CCC(OC)C(=O)NC(C)C.CCOC(C)C(=O)NC(C)C.
What is the InChIKey of 2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide?
The InChIKey is TXVSQHZIURBQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H17NO2/c1-5-7(11-4)8(10)9-6(2)3;1-5-11-7(4)8(10)9-6(2)3/h2*6-7H,5H2,1-4H3,(H,9,10).
What are the key properties of 2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide?
2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide has a molecular weight of 318.46 g/mol, XLogP of 1.87, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-propan-2-ylpropanamide;2-methoxy-N-propan-2-ylbutanamide is sourced from PubChem (CID 169160521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).