3-N,3-N,3-triethyloctane-3,4-diamine

C14H32N2 — CID 79061661

IUPAC3-N,3-N,3-triethyloctane-3,4-diamine
SMILESCCCCC(N)C(CC)(CC)N(CC)CC
InChIInChI=1S/C14H32N2/c1-6-11-12-13(15)14(7-2,8-3)16(9-4)10-5/h13H,6-12,15H2,1-5H3
InChIKeyAZUMIAOXOHBALZ-UHFFFAOYSA-N
MW228.42 g/mol
LogP3.40
Rot. Bonds9

About 3-N,3-N,3-triethyloctane-3,4-diamine

3-N,3-N,3-triethyloctane-3,4-diamine (PubChem CID 79061661) has the molecular formula C14H32N2 and a molecular weight of 228.42 g/mol. Its IUPAC name is 3-N,3-N,3-triethyloctane-3,4-diamine.

Molecular Properties

Compound Name3-N,3-N,3-triethyloctane-3,4-diamine
PubChem CID79061661
Molecular FormulaC14H32N2
Molecular Weight228.42 g/mol
Exact Mass228.26
IUPAC Name3-N,3-N,3-triethyloctane-3,4-diamine
SMILESCCCCC(N)C(CC)(CC)N(CC)CC
InChIInChI=1S/C14H32N2/c1-6-11-12-13(15)14(7-2,8-3)16(9-4)10-5/h13H,6-12,15H2,1-5H3
InChIKeyAZUMIAOXOHBALZ-UHFFFAOYSA-N
XLogP3.40
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.42
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-N,3-N,3-triethylnon-7-yne-3,4-diamine
CID 104806472
3-N,3-N,3-triethyl-7-methoxy-7-methyloctane-3,4-diamine
CID 103035847
3-(diethylamino)-3,6-diethyldecan-4-ol
CID 79061528
1,1,1-trifluorohexan-2-amine
CID 50998628
4,4-dimethylnonan-5-amine
CID 87513740
(2R)-1,1,1-trifluorohexan-2-amine;hydrochloride
CID 171203125
1,2-diaminohexane-1,1-diol
CID 19776231
2,2-difluoroheptan-3-amine
CID 130605107
4-N,4-N,4-triethylhex-1-ene-3,4-diamine
CID 79061790
1-(4-chloro-1,3-dimethylpyrazol-5-yl)-3-N,3-N,3-triethylpentane-2,3-diamine
CID 79059856
(3S)-2,2-dimethyloctan-3-amine
CID 93237613
3-N,3-N,3-triethyl-4-N-propylheptane-3,4-diamine
CID 79067168

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N,3-triethyloctane-3,4-diamine?
The IUPAC name of 3-N,3-N,3-triethyloctane-3,4-diamine (CID 79061661) is 3-N,3-N,3-triethyloctane-3,4-diamine.
What is the SMILES notation for 3-N,3-N,3-triethyloctane-3,4-diamine?
The canonical SMILES for 3-N,3-N,3-triethyloctane-3,4-diamine is CCCCC(N)C(CC)(CC)N(CC)CC.
What is the InChIKey of 3-N,3-N,3-triethyloctane-3,4-diamine?
The InChIKey is AZUMIAOXOHBALZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2/c1-6-11-12-13(15)14(7-2,8-3)16(9-4)10-5/h13H,6-12,15H2,1-5H3.
What are the key properties of 3-N,3-N,3-triethyloctane-3,4-diamine?
3-N,3-N,3-triethyloctane-3,4-diamine has a molecular weight of 228.42 g/mol, XLogP of 3.40, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N,3-triethyloctane-3,4-diamine is sourced from PubChem (CID 79061661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).