2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol

C15H29N3O — CID 131969924

IUPAC2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol
SMILESC=CN(CCO)C(=C)N(CCC)C(=C)N(C)CCC
InChIInChI=1S/C15H29N3O/c1-7-10-16(6)14(4)18(11-8-2)15(5)17(9-3)12-13-19/h9,19H,3-5,7-8,10-13H2,1-2,6H3
InChIKeyKOFANIBUXAXHPM-UHFFFAOYSA-N
MW267.42 g/mol
LogP2.42
Rot. Bonds11

About 2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol

2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol (PubChem CID 131969924) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol.

Molecular Properties

Compound Name2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol
PubChem CID131969924
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol
SMILESC=CN(CCO)C(=C)N(CCC)C(=C)N(C)CCC
InChIInChI=1S/C15H29N3O/c1-7-10-16(6)14(4)18(11-8-2)15(5)17(9-3)12-13-19/h9,19H,3-5,7-8,10-13H2,1-2,6H3
InChIKeyKOFANIBUXAXHPM-UHFFFAOYSA-N
XLogP2.42
TPSA29.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol?
The IUPAC name of 2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol (CID 131969924) is 2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol.
What is the SMILES notation for 2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol?
The canonical SMILES for 2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol is C=CN(CCO)C(=C)N(CCC)C(=C)N(C)CCC.
What is the InChIKey of 2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol?
The InChIKey is KOFANIBUXAXHPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-7-10-16(6)14(4)18(11-8-2)15(5)17(9-3)12-13-19/h9,19H,3-5,7-8,10-13H2,1-2,6H3.
What are the key properties of 2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol?
2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol has a molecular weight of 267.42 g/mol, XLogP of 2.42, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethenyl-[1-[1-[methyl(propyl)amino]ethenyl-propylamino]ethenyl]amino]ethanol is sourced from PubChem (CID 131969924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).