N,N-diethyl-2-methylidenepentanamide

C10H19NO — CID 12525277

IUPACN,N-diethyl-2-methylidenepentanamide
SMILESC=C(CCC)C(=O)N(CC)CC
InChIInChI=1S/C10H19NO/c1-5-8-9(4)10(12)11(6-2)7-3/h4-8H2,1-3H3
InChIKeyNUYFCDGEXOIVLS-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.21
Rot. Bonds5

About N,N-diethyl-2-methylidenepentanamide

N,N-diethyl-2-methylidenepentanamide (PubChem CID 12525277) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N,N-diethyl-2-methylidenepentanamide.

Molecular Properties

Compound NameN,N-diethyl-2-methylidenepentanamide
PubChem CID12525277
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN,N-diethyl-2-methylidenepentanamide
SMILESC=C(CCC)C(=O)N(CC)CC
InChIInChI=1S/C10H19NO/c1-5-8-9(4)10(12)11(6-2)7-3/h4-8H2,1-3H3
InChIKeyNUYFCDGEXOIVLS-UHFFFAOYSA-N
XLogP2.21
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.21
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

1-Methyl-3-methylidenepiperidin-2-one
CID 10486852
N,N-DI-N-Butylmethacrylamide
CID 9990299
Octanamide, N,N-diethyl-2-methylene-
CID 12142598
5-Hexenamide, N,N-diethyl-
CID 12249872
Dimethylaminopropylacrylamide
CID 18359659
n,n-Dimethyl-aminopropylacrylamide
CID 54306059
N-butyl-2-methylidene-N-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)butanamide
CID 58454465
N,N-diethyl-4,5,5,5-tetrafluoro-2-methylidenepentanamide
CID 162547679
2,2-difluoro-4-methyl-N,N-dipropylpent-4-enamide
CID 166658656
Propenamide, N,N,2-triethyl-
CID 587676
(3Z)-1-(2-methylpropyl)-3-(tributylstannylmethylidene)piperidin-2-one
CID 11385532
(E)-N,N-di(propan-2-yl)-2-propylhex-2-enamide
CID 101466460

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-methylidenepentanamide?
The IUPAC name of N,N-diethyl-2-methylidenepentanamide (CID 12525277) is N,N-diethyl-2-methylidenepentanamide.
What is the SMILES notation for N,N-diethyl-2-methylidenepentanamide?
The canonical SMILES for N,N-diethyl-2-methylidenepentanamide is C=C(CCC)C(=O)N(CC)CC.
What is the InChIKey of N,N-diethyl-2-methylidenepentanamide?
The InChIKey is NUYFCDGEXOIVLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-5-8-9(4)10(12)11(6-2)7-3/h4-8H2,1-3H3.
What are the key properties of N,N-diethyl-2-methylidenepentanamide?
N,N-diethyl-2-methylidenepentanamide has a molecular weight of 169.27 g/mol, XLogP of 2.21, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-methylidenepentanamide is sourced from PubChem (CID 12525277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).