N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide

C17H37N3O3 — CID 157213260

IUPACN,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide
SMILESCCC(=O)N(C)C.CCCC(=O)N(C)C.CCN(CC)C(C)=O
InChIInChI=1S/2C6H13NO.C5H11NO/c1-4-5-6(8)7(2)3;1-4-7(5-2)6(3)8;1-4-5(7)6(2)3/h2*4-5H2,1-3H3;4H2,1-3H3
InChIKeyASDAIOFBKHKLLX-UHFFFAOYSA-N
MW331.50 g/mol
LogP2.23
Rot. Bonds5

About N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide

N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide (PubChem CID 157213260) has the molecular formula C17H37N3O3 and a molecular weight of 331.50 g/mol. Its IUPAC name is N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide.

Molecular Properties

Compound NameN,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide
PubChem CID157213260
Molecular FormulaC17H37N3O3
Molecular Weight331.50 g/mol
Exact Mass331.28
IUPAC NameN,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide
SMILESCCC(=O)N(C)C.CCCC(=O)N(C)C.CCN(CC)C(C)=O
InChIInChI=1S/2C6H13NO.C5H11NO/c1-4-5-6(8)7(2)3;1-4-7(5-2)6(3)8;1-4-5(7)6(2)3/h2*4-5H2,1-3H3;4H2,1-3H3
InChIKeyASDAIOFBKHKLLX-UHFFFAOYSA-N
XLogP2.23
TPSA60.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.50
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethylacetamide;N,N-dimethylbutanamide;3-methoxy-N,N-dimethylpropanamide
CID 160545882
N,N-diethylbutanamide;N,N-dimethylpropanamide;N-ethyl-N-methylpropanamide
CID 18387019
N,N-dimethylbutanamide;hydrochloride
CID 87498306
acetic acid;N,N-diethylacetamide
CID 174447974
N-acetyl-N-methylbutanamide
CID 142271883
N,N-dimethylacetamide;N,N-dimethylpropanamide;N-methylacetamide
CID 165098180
2-[butanoyl-[2-(dimethylamino)ethyl]amino]acetic acid
CID 103802903
N-ethyl-N-propylacetamide;methane;propane
CID 161155898
N-(dimethylcarbamoyl)-N-methylbutanamide
CID 178179553
N,N-dimethyldecanamide;N,N-dimethyloctanamide
CID 155099591
N-ethyl-N-(hydroxymethyl)propanamide
CID 18715922
CID 18739109
CID 18739109

Frequently Asked Questions

What is the IUPAC name of N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide?
The IUPAC name of N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide (CID 157213260) is N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide.
What is the SMILES notation for N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide?
The canonical SMILES for N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide is CCC(=O)N(C)C.CCCC(=O)N(C)C.CCN(CC)C(C)=O.
What is the InChIKey of N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide?
The InChIKey is ASDAIOFBKHKLLX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H13NO.C5H11NO/c1-4-5-6(8)7(2)3;1-4-7(5-2)6(3)8;1-4-5(7)6(2)3/h2*4-5H2,1-3H3;4H2,1-3H3.
What are the key properties of N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide?
N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide has a molecular weight of 331.50 g/mol, XLogP of 2.23, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylacetamide;N,N-dimethylbutanamide;N,N-dimethylpropanamide is sourced from PubChem (CID 157213260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).