N,N-dimethylpropan-1-amine;bis(prop-2-enamide)

C11H23N3O2 — CID 158610265

IUPACN,N-dimethylpropan-1-amine;bis(prop-2-enamide)
SMILESC=CC(N)=O.C=CC(N)=O.CCCN(C)C
InChIInChI=1S/C5H13N.2C3H5NO/c1-4-5-6(2)3;2*1-2-3(4)5/h4-5H2,1-3H3;2*2H,1H2,(H2,4,5)
InChIKeyHWTDZOWZIWIHJH-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.27
Rot. Bonds4

About N,N-dimethylpropan-1-amine;bis(prop-2-enamide)

N,N-dimethylpropan-1-amine;bis(prop-2-enamide) (PubChem CID 158610265) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is N,N-dimethylpropan-1-amine;bis(prop-2-enamide).

Molecular Properties

Compound NameN,N-dimethylpropan-1-amine;bis(prop-2-enamide)
PubChem CID158610265
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC NameN,N-dimethylpropan-1-amine;bis(prop-2-enamide)
SMILESC=CC(N)=O.C=CC(N)=O.CCCN(C)C
InChIInChI=1S/C5H13N.2C3H5NO/c1-4-5-6(2)3;2*1-2-3(4)5/h4-5H2,1-3H3;2*2H,1H2,(H2,4,5)
InChIKeyHWTDZOWZIWIHJH-UHFFFAOYSA-N
XLogP0.27
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

pentane;prop-2-enamide
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acetic acid;azane;N,N-dimethylpropan-1-amine
CID 89442730
N-[3-(dimethylamino)propyl]prop-2-enamide;prop-2-enamide;hydrochloride
CID 173080700
decanamide;N,N-dimethylpropan-1-amine
CID 160827812
N'-(3-aminopropyl)-N'-methylpropane-1,3-diamine;bis(prop-2-enamide)
CID 87098923
prop-2-enamide;tetraethylazanium
CID 160757497
methanamine;prop-2-enamide;hydrate
CID 174696935
acetamide;prop-2-enamide
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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylpropan-1-amine;bis(prop-2-enamide)?
The IUPAC name of N,N-dimethylpropan-1-amine;bis(prop-2-enamide) (CID 158610265) is N,N-dimethylpropan-1-amine;bis(prop-2-enamide).
What is the SMILES notation for N,N-dimethylpropan-1-amine;bis(prop-2-enamide)?
The canonical SMILES for N,N-dimethylpropan-1-amine;bis(prop-2-enamide) is C=CC(N)=O.C=CC(N)=O.CCCN(C)C.
What is the InChIKey of N,N-dimethylpropan-1-amine;bis(prop-2-enamide)?
The InChIKey is HWTDZOWZIWIHJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.2C3H5NO/c1-4-5-6(2)3;2*1-2-3(4)5/h4-5H2,1-3H3;2*2H,1H2,(H2,4,5).
What are the key properties of N,N-dimethylpropan-1-amine;bis(prop-2-enamide)?
N,N-dimethylpropan-1-amine;bis(prop-2-enamide) has a molecular weight of 229.32 g/mol, XLogP of 0.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylpropan-1-amine;bis(prop-2-enamide) is sourced from PubChem (CID 158610265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).