N-butyl-N-ethyl-2-methylpropanamide

C10H21NO — CID 60724225

IUPACN-butyl-N-ethyl-2-methylpropanamide
SMILESCCCCN(CC)C(=O)C(C)C
InChIInChI=1S/C10H21NO/c1-5-7-8-11(6-2)10(12)9(3)4/h9H,5-8H2,1-4H3
InChIKeyZBBHQFJZPCHUOA-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.29
Rot. Bonds5

About N-butyl-N-ethyl-2-methylpropanamide

N-butyl-N-ethyl-2-methylpropanamide (PubChem CID 60724225) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N-butyl-N-ethyl-2-methylpropanamide.

Molecular Properties

Compound NameN-butyl-N-ethyl-2-methylpropanamide
PubChem CID60724225
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN-butyl-N-ethyl-2-methylpropanamide
SMILESCCCCN(CC)C(=O)C(C)C
InChIInChI=1S/C10H21NO/c1-5-7-8-11(6-2)10(12)9(3)4/h9H,5-8H2,1-4H3
InChIKeyZBBHQFJZPCHUOA-UHFFFAOYSA-N
XLogP2.29
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-butyl-N-ethyl-2-methylpropanamide?
The IUPAC name of N-butyl-N-ethyl-2-methylpropanamide (CID 60724225) is N-butyl-N-ethyl-2-methylpropanamide.
What is the SMILES notation for N-butyl-N-ethyl-2-methylpropanamide?
The canonical SMILES for N-butyl-N-ethyl-2-methylpropanamide is CCCCN(CC)C(=O)C(C)C.
What is the InChIKey of N-butyl-N-ethyl-2-methylpropanamide?
The InChIKey is ZBBHQFJZPCHUOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-5-7-8-11(6-2)10(12)9(3)4/h9H,5-8H2,1-4H3.
What are the key properties of N-butyl-N-ethyl-2-methylpropanamide?
N-butyl-N-ethyl-2-methylpropanamide has a molecular weight of 171.28 g/mol, XLogP of 2.29, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-ethyl-2-methylpropanamide is sourced from PubChem (CID 60724225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).