5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine

C11H24N2 — CID 123823524

IUPAC5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine
SMILESCCC(CN)CCC(C)=CN(C)C
InChIInChI=1S/C11H24N2/c1-5-11(8-12)7-6-10(2)9-13(3)4/h9,11H,5-8,12H2,1-4H3
InChIKeyADTBEIPBKUYFEH-UHFFFAOYSA-N
MW184.33 g/mol
LogP2.22
Rot. Bonds6

About 5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine

5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine (PubChem CID 123823524) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine.

Molecular Properties

Compound Name5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine
PubChem CID123823524
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine
SMILESCCC(CN)CCC(C)=CN(C)C
InChIInChI=1S/C11H24N2/c1-5-11(8-12)7-6-10(2)9-13(3)4/h9,11H,5-8,12H2,1-4H3
InChIKeyADTBEIPBKUYFEH-UHFFFAOYSA-N
XLogP2.22
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-methylpropyl)-4-propan-2-yl-2,3-dihydro-1H-pyrrole
CID 59142831
2-Ethyl-5-methylhex-5-en-1-amine
CID 87112388
4-Methyl-5-methylideneheptan-1-amine
CID 87112485
3-Prop-1-en-2-ylhexane-1,6-diamine
CID 89024909
(2S)-2-ethyl-5-methylidenehexane-1,6-diamine
CID 89038830
2-Ethyl-4-methyl-3-methylidenehexan-1-amine
CID 89185225
5-[2-(Methylaminomethyl)prop-2-enyl]nonane-1,9-diamine
CID 90886795
2-[(2R,3R)-2,3-dimethyl-2,3-dihydro-1H-pyrrol-4-yl]ethanamine
CID 117640082
5,6-dimethyl-7-(methylideneamino)-N-propylhept-6-en-1-amine
CID 123313909
4-(1,4-dimethyl-3,4-dihydro-2H-pyridin-5-yl)-N,3-dimethylbutan-1-amine
CID 123336827
N,N,N',4-tetramethyl-2-propan-2-ylhex-1-ene-1,6-diamine
CID 123797265
4-Methyl-2-propylpent-4-en-1-amine
CID 123889365

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine?
The IUPAC name of 5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine (CID 123823524) is 5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine.
What is the SMILES notation for 5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine?
The canonical SMILES for 5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine is CCC(CN)CCC(C)=CN(C)C.
What is the InChIKey of 5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine?
The InChIKey is ADTBEIPBKUYFEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-5-11(8-12)7-6-10(2)9-13(3)4/h9,11H,5-8,12H2,1-4H3.
What are the key properties of 5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine?
5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine has a molecular weight of 184.33 g/mol, XLogP of 2.22, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N,N,2-trimethylhex-1-ene-1,6-diamine is sourced from PubChem (CID 123823524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).