azane;N-methyl-2-methylidenepentanamide

C7H16N2O — CID 174850650

IUPACazane;N-methyl-2-methylidenepentanamide
SMILESC=C(CCC)C(=O)NC.N
InChIInChI=1S/C7H13NO.H3N/c1-4-5-6(2)7(9)8-3;/h2,4-5H2,1,3H3,(H,8,9);1H3
InChIKeyBVZGORSVCXTKTE-UHFFFAOYSA-N
MW144.22 g/mol
LogP1.25
Rot. Bonds3

About azane;N-methyl-2-methylidenepentanamide

azane;N-methyl-2-methylidenepentanamide (PubChem CID 174850650) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is azane;N-methyl-2-methylidenepentanamide.

Molecular Properties

Compound Nameazane;N-methyl-2-methylidenepentanamide
PubChem CID174850650
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Nameazane;N-methyl-2-methylidenepentanamide
SMILESC=C(CCC)C(=O)NC.N
InChIInChI=1S/C7H13NO.H3N/c1-4-5-6(2)7(9)8-3;/h2,4-5H2,1,3H3,(H,8,9);1H3
InChIKeyBVZGORSVCXTKTE-UHFFFAOYSA-N
XLogP1.25
TPSA64.10 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-hydroxy-2-methylidenepentanamide
CID 22256183
2-(fluoromethyl)-N-methylprop-2-enamide
CID 90023989
4,5-dimethylideneoctane
CID 13294231
4-methylideneheptan-3-one
CID 13485259
N,N-bis(methylamino)-2-methylidenepentanamide;hydrochloride
CID 141246092
2-methylidene-N-triethoxysilylpentanamide
CID 87640419
2-methylidenepentanoic acid;hydrate
CID 88770361
N-benzyl-2-methylidenepentanamide
CID 130015312
N-chloro-2-methylidenehexanamide
CID 91615542
N,3-dimethyl-2-propylpent-2-enamide
CID 175801698
N-ethyl-2-methylidenehexanamide
CID 140513535
N-methyl-2-methylidene-N'-propylpropanediamide
CID 102186954

Frequently Asked Questions

What is the IUPAC name of azane;N-methyl-2-methylidenepentanamide?
The IUPAC name of azane;N-methyl-2-methylidenepentanamide (CID 174850650) is azane;N-methyl-2-methylidenepentanamide.
What is the SMILES notation for azane;N-methyl-2-methylidenepentanamide?
The canonical SMILES for azane;N-methyl-2-methylidenepentanamide is C=C(CCC)C(=O)NC.N.
What is the InChIKey of azane;N-methyl-2-methylidenepentanamide?
The InChIKey is BVZGORSVCXTKTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO.H3N/c1-4-5-6(2)7(9)8-3;/h2,4-5H2,1,3H3,(H,8,9);1H3.
What are the key properties of azane;N-methyl-2-methylidenepentanamide?
azane;N-methyl-2-methylidenepentanamide has a molecular weight of 144.22 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;N-methyl-2-methylidenepentanamide is sourced from PubChem (CID 174850650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).