N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine

C10H22N2 — CID 90253107

IUPACN'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine
SMILESC=C(CC)N(C)CCN(C)CC
InChIInChI=1S/C10H22N2/c1-6-10(3)12(5)9-8-11(4)7-2/h3,6-9H2,1-2,4-5H3
InChIKeyMTKNQOOPDQOXBO-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.79
Rot. Bonds6

About N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine

N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine (PubChem CID 90253107) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine
PubChem CID90253107
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine
SMILESC=C(CC)N(C)CCN(C)CC
InChIInChI=1S/C10H22N2/c1-6-10(3)12(5)9-8-11(4)7-2/h3,6-9H2,1-2,4-5H3
InChIKeyMTKNQOOPDQOXBO-UHFFFAOYSA-N
XLogP1.79
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine?
The IUPAC name of N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine (CID 90253107) is N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine?
The canonical SMILES for N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine is C=C(CC)N(C)CCN(C)CC.
What is the InChIKey of N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine?
The InChIKey is MTKNQOOPDQOXBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-6-10(3)12(5)9-8-11(4)7-2/h3,6-9H2,1-2,4-5H3.
What are the key properties of N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine?
N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.79, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-but-1-en-2-yl-N-ethyl-N,N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 90253107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).