(Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide

C10H20N2O — CID 167255132

IUPAC(Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide
SMILESCCC(C)/C(=C/C(=O)N(C)C)NC
InChIInChI=1S/C10H20N2O/c1-6-8(2)9(11-3)7-10(13)12(4)5/h7-8,11H,6H2,1-5H3/b9-7-
InChIKeyGEAMKXOPBOFNAQ-CLFYSBASSA-N
MW184.28 g/mol
LogP1.22
Rot. Bonds4

About (Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide

(Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide (PubChem CID 167255132) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide.

Molecular Properties

Compound Name(Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide
PubChem CID167255132
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide
SMILESCCC(C)/C(=C/C(=O)N(C)C)NC
InChIInChI=1S/C10H20N2O/c1-6-8(2)9(11-3)7-10(13)12(4)5/h7-8,11H,6H2,1-5H3/b9-7-
InChIKeyGEAMKXOPBOFNAQ-CLFYSBASSA-N
XLogP1.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide?
The IUPAC name of (Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide (CID 167255132) is (Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide.
What is the SMILES notation for (Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide?
The canonical SMILES for (Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide is CCC(C)/C(=C/C(=O)N(C)C)NC.
What is the InChIKey of (Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide?
The InChIKey is GEAMKXOPBOFNAQ-CLFYSBASSA-N. The full InChI is InChI=1S/C10H20N2O/c1-6-8(2)9(11-3)7-10(13)12(4)5/h7-8,11H,6H2,1-5H3/b9-7-.
What are the key properties of (Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide?
(Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide has a molecular weight of 184.28 g/mol, XLogP of 1.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,N,4-trimethyl-3-(methylamino)hex-2-enamide is sourced from PubChem (CID 167255132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).