2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine

C10H24N2 — CID 79092726

IUPAC2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine
SMILESCCCCC(CN(C)C)NCC
InChIInChI=1S/C10H24N2/c1-5-7-8-10(11-6-2)9-12(3)4/h10-11H,5-9H2,1-4H3
InChIKeyHMVUPCDDZSXDPT-UHFFFAOYSA-N
MW172.32 g/mol
LogP1.72
Rot. Bonds7

About 2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine

2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine (PubChem CID 79092726) has the molecular formula C10H24N2 and a molecular weight of 172.32 g/mol. Its IUPAC name is 2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine.

Molecular Properties

Compound Name2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine
PubChem CID79092726
Molecular FormulaC10H24N2
Molecular Weight172.32 g/mol
Exact Mass172.19
IUPAC Name2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine
SMILESCCCCC(CN(C)C)NCC
InChIInChI=1S/C10H24N2/c1-5-7-8-10(11-6-2)9-12(3)4/h10-11H,5-9H2,1-4H3
InChIKeyHMVUPCDDZSXDPT-UHFFFAOYSA-N
XLogP1.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.32
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-ethyl-1-N,1-N-dimethylnonane-1,2-diamine
CID 79092822
1-N,1-N-dimethyl-2-N-propyldodecane-1,2-diamine
CID 79089113
N-ethyldecan-5-amine
CID 79405026
3-N-ethyl-1-N,1-N-dimethyloctane-1,3-diamine
CID 115346552
N-ethyltetradecan-7-amine
CID 87847195
N-ethylhexadecan-4-amine
CID 63413885
N-ethylnonan-3-amine
CID 60996683
N-ethyl-1,1,1-trifluorooctan-4-amine
CID 79404596
N-ethyl-2-methylheptadecan-6-amine
CID 105028964
N-heptan-3-yl-N',N'-dimethylethane-1,2-diamine
CID 63946060
2-N-hexyl-1-N,1-N-dimethylbutane-1,2-diamine
CID 102401711
N-ethyldecan-3-amine;dihydrochloride
CID 175708733

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine?
The IUPAC name of 2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine (CID 79092726) is 2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine.
What is the SMILES notation for 2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine?
The canonical SMILES for 2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine is CCCCC(CN(C)C)NCC.
What is the InChIKey of 2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine?
The InChIKey is HMVUPCDDZSXDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2/c1-5-7-8-10(11-6-2)9-12(3)4/h10-11H,5-9H2,1-4H3.
What are the key properties of 2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine?
2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine has a molecular weight of 172.32 g/mol, XLogP of 1.72, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-1-N,1-N-dimethylhexane-1,2-diamine is sourced from PubChem (CID 79092726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).