N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide

C12H20N2O2 — CID 58444869

IUPACN-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide
SMILESC=CN(CC(O)CN(C=C)C(C)=O)C(=C)C
InChIInChI=1S/C12H20N2O2/c1-6-13(10(3)4)8-12(16)9-14(7-2)11(5)15/h6-7,12,16H,1-3,8-9H2,4-5H3
InChIKeyCVUVPZTWTAFHFJ-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.32
Rot. Bonds7

About N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide

N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide (PubChem CID 58444869) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide.

Molecular Properties

Compound NameN-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide
PubChem CID58444869
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC NameN-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide
SMILESC=CN(CC(O)CN(C=C)C(C)=O)C(=C)C
InChIInChI=1S/C12H20N2O2/c1-6-13(10(3)4)8-12(16)9-14(7-2)11(5)15/h6-7,12,16H,1-3,8-9H2,4-5H3
InChIKeyCVUVPZTWTAFHFJ-UHFFFAOYSA-N
XLogP1.32
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide?
The IUPAC name of N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide (CID 58444869) is N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide.
What is the SMILES notation for N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide?
The canonical SMILES for N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide is C=CN(CC(O)CN(C=C)C(C)=O)C(=C)C.
What is the InChIKey of N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide?
The InChIKey is CVUVPZTWTAFHFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-6-13(10(3)4)8-12(16)9-14(7-2)11(5)15/h6-7,12,16H,1-3,8-9H2,4-5H3.
What are the key properties of N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide?
N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide has a molecular weight of 224.30 g/mol, XLogP of 1.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N-[3-[ethenyl(prop-1-en-2-yl)amino]-2-hydroxypropyl]acetamide is sourced from PubChem (CID 58444869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).