N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide

C11H19N3O — CID 143834995

IUPACN-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide
SMILESC=C/C=N\C(=C)N(C)CCN(C)C(C)=O
InChIInChI=1S/C11H19N3O/c1-6-7-12-10(2)13(4)8-9-14(5)11(3)15/h6-7H,1-2,8-9H2,3-5H3/b12-7-
InChIKeyDVNJBIDAHWEWAW-GHXNOFRVSA-N
MW209.29 g/mol
LogP1.12
Rot. Bonds6

About N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide

N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide (PubChem CID 143834995) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide
PubChem CID143834995
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide
SMILESC=C/C=N\C(=C)N(C)CCN(C)C(C)=O
InChIInChI=1S/C11H19N3O/c1-6-7-12-10(2)13(4)8-9-14(5)11(3)15/h6-7H,1-2,8-9H2,3-5H3/b12-7-
InChIKeyDVNJBIDAHWEWAW-GHXNOFRVSA-N
XLogP1.12
TPSA35.91 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide?
The IUPAC name of N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide (CID 143834995) is N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide.
What is the SMILES notation for N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide?
The canonical SMILES for N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide is C=C/C=N\C(=C)N(C)CCN(C)C(C)=O.
What is the InChIKey of N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide?
The InChIKey is DVNJBIDAHWEWAW-GHXNOFRVSA-N. The full InChI is InChI=1S/C11H19N3O/c1-6-7-12-10(2)13(4)8-9-14(5)11(3)15/h6-7H,1-2,8-9H2,3-5H3/b12-7-.
What are the key properties of N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide?
N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide has a molecular weight of 209.29 g/mol, XLogP of 1.12, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-[methyl-[1-[(Z)-prop-2-enylideneamino]ethenyl]amino]ethyl]acetamide is sourced from PubChem (CID 143834995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).