N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide

C12H24N2O — CID 118358855

IUPACN-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide
SMILESC=C(CN(CC)CC)NC(=O)C(C)(C)C
InChIInChI=1S/C12H24N2O/c1-7-14(8-2)9-10(3)13-11(15)12(4,5)6/h3,7-9H2,1-2,4-6H3,(H,13,15)
InChIKeyDASBYLFIMTWATD-UHFFFAOYSA-N
MW212.34 g/mol
LogP2.00
Rot. Bonds5

About N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide

N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide (PubChem CID 118358855) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide
PubChem CID118358855
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide
SMILESC=C(CN(CC)CC)NC(=O)C(C)(C)C
InChIInChI=1S/C12H24N2O/c1-7-14(8-2)9-10(3)13-11(15)12(4,5)6/h3,7-9H2,1-2,4-6H3,(H,13,15)
InChIKeyDASBYLFIMTWATD-UHFFFAOYSA-N
XLogP2.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide?
The IUPAC name of N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide (CID 118358855) is N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide is C=C(CN(CC)CC)NC(=O)C(C)(C)C.
What is the InChIKey of N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide?
The InChIKey is DASBYLFIMTWATD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-7-14(8-2)9-10(3)13-11(15)12(4,5)6/h3,7-9H2,1-2,4-6H3,(H,13,15).
What are the key properties of N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide?
N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide has a molecular weight of 212.34 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylamino)prop-1-en-2-yl]-2,2-dimethylpropanamide is sourced from PubChem (CID 118358855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).