azane;N,N,2-trimethylprop-2-enamide

C6H14N2O — CID 162327856

IUPACazane;N,N,2-trimethylprop-2-enamide
SMILESC=C(C)C(=O)N(C)C.N
InChIInChI=1S/C6H11NO.H3N/c1-5(2)6(8)7(3)4;/h1H2,2-4H3;1H3
InChIKeyGWRWYNBNFMJYBO-UHFFFAOYSA-N
MW130.19 g/mol
LogP0.81
Rot. Bonds1

About azane;N,N,2-trimethylprop-2-enamide

azane;N,N,2-trimethylprop-2-enamide (PubChem CID 162327856) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is azane;N,N,2-trimethylprop-2-enamide.

Molecular Properties

Compound Nameazane;N,N,2-trimethylprop-2-enamide
PubChem CID162327856
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Nameazane;N,N,2-trimethylprop-2-enamide
SMILESC=C(C)C(=O)N(C)C.N
InChIInChI=1S/C6H11NO.H3N/c1-5(2)6(8)7(3)4;/h1H2,2-4H3;1H3
InChIKeyGWRWYNBNFMJYBO-UHFFFAOYSA-N
XLogP0.81
TPSA55.31 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,2-dimethyl-N-(3-methylbuta-1,3-dien-2-yl)prop-2-enamide
CID 171556430
methyl 2-methylprop-2-enoate;prop-1-ene;N,N,2-trimethylprop-2-enamide
CID 158640879
N',N',2-trimethyl-N-prop-1-en-2-ylprop-2-enehydrazide
CID 15525104
CID 58987178
CID 58987178
N,N-diacetyl-2-methylprop-2-enamide
CID 22336365
azane;N,N-dimethylacetamide
CID 161145572
N-(2-hydroxypropyl)-2-methylprop-2-enehydrazide
CID 174628871
1-pyrrolidin-1-ylprop-2-en-1-one;N,N,2-trimethylprop-2-enamide
CID 70414233
N-(iodomethyl)-N,2-dimethylprop-2-enamide
CID 146497620
N,N-dimethylacetamide;formaldehyde
CID 54040691
N,N,3-trimethyl-2-methylidenebutanamide
CID 57080569
N,N-dimethylprop-1-en-2-amine;methane;2-methylprop-1-ene;propan-2-one
CID 158433612

Frequently Asked Questions

What is the IUPAC name of azane;N,N,2-trimethylprop-2-enamide?
The IUPAC name of azane;N,N,2-trimethylprop-2-enamide (CID 162327856) is azane;N,N,2-trimethylprop-2-enamide.
What is the SMILES notation for azane;N,N,2-trimethylprop-2-enamide?
The canonical SMILES for azane;N,N,2-trimethylprop-2-enamide is C=C(C)C(=O)N(C)C.N.
What is the InChIKey of azane;N,N,2-trimethylprop-2-enamide?
The InChIKey is GWRWYNBNFMJYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.H3N/c1-5(2)6(8)7(3)4;/h1H2,2-4H3;1H3.
What are the key properties of azane;N,N,2-trimethylprop-2-enamide?
azane;N,N,2-trimethylprop-2-enamide has a molecular weight of 130.19 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;N,N,2-trimethylprop-2-enamide is sourced from PubChem (CID 162327856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).