N,N-diethyl-3-methyl-2-methylidenebutanamide

C10H19NO — CID 592965

IUPACN,N-diethyl-3-methyl-2-methylidenebutanamide
SMILESC=C(C(=O)N(CC)CC)C(C)C
InChIInChI=1S/C10H19NO/c1-6-11(7-2)10(12)9(5)8(3)4/h8H,5-7H2,1-4H3
InChIKeyMLVYUTUBSSVUFX-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.07
Rot. Bonds4

About N,N-diethyl-3-methyl-2-methylidenebutanamide

N,N-diethyl-3-methyl-2-methylidenebutanamide (PubChem CID 592965) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N,N-diethyl-3-methyl-2-methylidenebutanamide.

Molecular Properties

Compound NameN,N-diethyl-3-methyl-2-methylidenebutanamide
PubChem CID592965
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN,N-diethyl-3-methyl-2-methylidenebutanamide
SMILESC=C(C(=O)N(CC)CC)C(C)C
InChIInChI=1S/C10H19NO/c1-6-11(7-2)10(12)9(5)8(3)4/h8H,5-7H2,1-4H3
InChIKeyMLVYUTUBSSVUFX-UHFFFAOYSA-N
XLogP2.07
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N,N-DI-N-Butylmethacrylamide
CID 9990299
N-butyl-2-methylidene-N-(3,3,4,4,4-pentafluorobutyl)butanamide
CID 59297284
N-(3,3-difluoropropyl)-3-methyl-2-methylidene-N-propylbutanamide
CID 89352169
Propenamide, N,N,2-triethyl-
CID 587676
3-methyl-N,N-diprop-2-enylbutanamide
CID 4403931
N-(3-methylbutyl)-N-prop-2-enylprop-2-enamide
CID 134197664
4-Pentenamide, N,N-diethyl-4-methyl-2-methylene-
CID 556830
N1,N1,N4,N4-Tetraisobutyl-2-methylene-succinamide
CID 614197
2,3-dimethyl-N,N-di(propan-2-yl)but-3-enamide
CID 12434544
2-methyl-N,N-bis(prop-2-enyl)butanamide
CID 4628434
2-methyl-N,N-dipropylprop-2-enamide
CID 10374838
1,4-Dimethyl-3-methylidenepyrrolidin-2-one
CID 12294828

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-methyl-2-methylidenebutanamide?
The IUPAC name of N,N-diethyl-3-methyl-2-methylidenebutanamide (CID 592965) is N,N-diethyl-3-methyl-2-methylidenebutanamide.
What is the SMILES notation for N,N-diethyl-3-methyl-2-methylidenebutanamide?
The canonical SMILES for N,N-diethyl-3-methyl-2-methylidenebutanamide is C=C(C(=O)N(CC)CC)C(C)C.
What is the InChIKey of N,N-diethyl-3-methyl-2-methylidenebutanamide?
The InChIKey is MLVYUTUBSSVUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-6-11(7-2)10(12)9(5)8(3)4/h8H,5-7H2,1-4H3.
What are the key properties of N,N-diethyl-3-methyl-2-methylidenebutanamide?
N,N-diethyl-3-methyl-2-methylidenebutanamide has a molecular weight of 169.27 g/mol, XLogP of 2.07, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-methyl-2-methylidenebutanamide is sourced from PubChem (CID 592965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).