N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide

C11H18N2O2 — CID 56990592

IUPACN-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide
SMILESC=CN(C(C)=O)C(CC)N(C=C)C(C)=O
InChIInChI=1S/C11H18N2O2/c1-6-11(12(7-2)9(4)14)13(8-3)10(5)15/h7-8,11H,2-3,6H2,1,4-5H3
InChIKeyWEFVPGQGKVCGGM-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.71
Rot. Bonds5

About N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide

N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide (PubChem CID 56990592) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide.

Molecular Properties

Compound NameN-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide
PubChem CID56990592
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide
SMILESC=CN(C(C)=O)C(CC)N(C=C)C(C)=O
InChIInChI=1S/C11H18N2O2/c1-6-11(12(7-2)9(4)14)13(8-3)10(5)15/h7-8,11H,2-3,6H2,1,4-5H3
InChIKeyWEFVPGQGKVCGGM-UHFFFAOYSA-N
XLogP1.71
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-ethenyl-N-propan-2-ylbutanamide
CID 87389097
N-acetyl-N-ethenylacetamide
CID 15657389
N-butan-2-yl-N-(2,2-dichloroethenyl)acetamide
CID 12914710
1-[amino(ethenyl)amino]propan-2-one
CID 123506750
propane;propan-2-one;prop-1-ene
CID 160807834
ethane;N-ethenyl-N-methylacetamide
CID 143223383
N-ethenyl-N-propan-2-yldecanamide
CID 87389049
3-ethylhex-5-en-2-one
CID 58995117
acetic acid;but-1-ene
CID 88520349
[(3R)-pent-1-en-3-yl] acetate
CID 92859949
1-ethenyl-3-methyl-1,3-di(propan-2-yl)urea
CID 166800460
4-ethylhept-6-en-2-one
CID 87771917

Frequently Asked Questions

What is the IUPAC name of N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide?
The IUPAC name of N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide (CID 56990592) is N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide.
What is the SMILES notation for N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide?
The canonical SMILES for N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide is C=CN(C(C)=O)C(CC)N(C=C)C(C)=O.
What is the InChIKey of N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide?
The InChIKey is WEFVPGQGKVCGGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-6-11(12(7-2)9(4)14)13(8-3)10(5)15/h7-8,11H,2-3,6H2,1,4-5H3.
What are the key properties of N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide?
N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide has a molecular weight of 210.28 g/mol, XLogP of 1.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide is sourced from PubChem (CID 56990592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).