N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide

C10H21N3O — CID 59110192

IUPACN-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide
SMILESC/C=C(/NC(C)N(C)C(C)=O)N(C)C
InChIInChI=1S/C10H21N3O/c1-7-10(12(4)5)11-8(2)13(6)9(3)14/h7-8,11H,1-6H3/b10-7-
InChIKeyGCLDNHXNRLOWRA-YFHOEESVSA-N
MW199.30 g/mol
LogP0.82
Rot. Bonds4

About N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide

N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide (PubChem CID 59110192) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide
PubChem CID59110192
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC NameN-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide
SMILESC/C=C(/NC(C)N(C)C(C)=O)N(C)C
InChIInChI=1S/C10H21N3O/c1-7-10(12(4)5)11-8(2)13(6)9(3)14/h7-8,11H,1-6H3/b10-7-
InChIKeyGCLDNHXNRLOWRA-YFHOEESVSA-N
XLogP0.82
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide?
The IUPAC name of N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide (CID 59110192) is N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide.
What is the SMILES notation for N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide?
The canonical SMILES for N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide is C/C=C(/NC(C)N(C)C(C)=O)N(C)C.
What is the InChIKey of N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide?
The InChIKey is GCLDNHXNRLOWRA-YFHOEESVSA-N. The full InChI is InChI=1S/C10H21N3O/c1-7-10(12(4)5)11-8(2)13(6)9(3)14/h7-8,11H,1-6H3/b10-7-.
What are the key properties of N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide?
N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide has a molecular weight of 199.30 g/mol, XLogP of 0.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[[(Z)-1-(dimethylamino)prop-1-enyl]amino]ethyl]-N-methylacetamide is sourced from PubChem (CID 59110192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).