N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine

C15H33N3 — CID 23542189

IUPACN,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine
SMILESC=C(C)N(CC)CCN(CC)CCN(CC)CC
InChIInChI=1S/C15H33N3/c1-7-16(8-2)11-12-17(9-3)13-14-18(10-4)15(5)6/h5,7-14H2,1-4,6H3
InChIKeyZYEJGJASSABOPD-UHFFFAOYSA-N
MW255.45 g/mol
LogP2.51
Rot. Bonds11

About N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine

N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine (PubChem CID 23542189) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine
PubChem CID23542189
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC NameN,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine
SMILESC=C(C)N(CC)CCN(CC)CCN(CC)CC
InChIInChI=1S/C15H33N3/c1-7-16(8-2)11-12-17(9-3)13-14-18(10-4)15(5)6/h5,7-14H2,1-4,6H3
InChIKeyZYEJGJASSABOPD-UHFFFAOYSA-N
XLogP2.51
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine?
The IUPAC name of N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine (CID 23542189) is N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine.
What is the SMILES notation for N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine?
The canonical SMILES for N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine is C=C(C)N(CC)CCN(CC)CCN(CC)CC.
What is the InChIKey of N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine?
The InChIKey is ZYEJGJASSABOPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-7-16(8-2)11-12-17(9-3)13-14-18(10-4)15(5)6/h5,7-14H2,1-4,6H3.
What are the key properties of N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine?
N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine has a molecular weight of 255.45 g/mol, XLogP of 2.51, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine is sourced from PubChem (CID 23542189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).