2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine

C16H36N2 — CID 79052772

IUPAC2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine
SMILESCCCCCCCC(NC)C(C)(C)N(CC)CC
InChIInChI=1S/C16H36N2/c1-7-10-11-12-13-14-15(17-6)16(4,5)18(8-2)9-3/h15,17H,7-14H2,1-6H3
InChIKeyTZZVCVIRLSCYBB-UHFFFAOYSA-N
MW256.48 g/mol
LogP4.06
Rot. Bonds11

About 2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine

2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine (PubChem CID 79052772) has the molecular formula C16H36N2 and a molecular weight of 256.48 g/mol. Its IUPAC name is 2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine.

Molecular Properties

Compound Name2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine
PubChem CID79052772
Molecular FormulaC16H36N2
Molecular Weight256.48 g/mol
Exact Mass256.29
IUPAC Name2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine
SMILESCCCCCCCC(NC)C(C)(C)N(CC)CC
InChIInChI=1S/C16H36N2/c1-7-10-11-12-13-14-15(17-6)16(4,5)18(8-2)9-3/h15,17H,7-14H2,1-6H3
InChIKeyTZZVCVIRLSCYBB-UHFFFAOYSA-N
XLogP4.06
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.48
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-N,2-N-diethyl-3-N,2-dimethyldodecane-2,3-diamine
CID 79053578
2-N,2-N-diethyl-3-N,2-dimethylnonane-2,3-diamine
CID 79052771
2-N,2-N-diethyl-6-methoxy-3-N,2-dimethylhexane-2,3-diamine
CID 114856169
N,3,3-trimethylhexadecan-4-amine
CID 115846506
2-(diethylamino)-2-methyldecan-3-ol
CID 79053549
(4R)-N,3,3-trimethylnonan-4-amine
CID 126620511
2-N,2-N-diethyl-3-N,2,6-trimethylhept-6-ene-2,3-diamine
CID 114475156
1-N',1-N',1-N",1-N"-tetrabutyl-1-N,2-N-dimethyldecane-1,1,1,2-tetramine
CID 151707623
2-methoxy-N,2-dimethyloctan-3-amine
CID 79198599
3-N,3-N-diethyl-3-methyl-4-N-propyldecane-3,4-diamine
CID 79069155
3-N,3-N-diethyl-3-methyl-4-N-propylundecane-3,4-diamine
CID 79058558
3-methoxy-N,3-dimethylundecan-4-amine
CID 116757603

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine?
The IUPAC name of 2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine (CID 79052772) is 2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine.
What is the SMILES notation for 2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine?
The canonical SMILES for 2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine is CCCCCCCC(NC)C(C)(C)N(CC)CC.
What is the InChIKey of 2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine?
The InChIKey is TZZVCVIRLSCYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36N2/c1-7-10-11-12-13-14-15(17-6)16(4,5)18(8-2)9-3/h15,17H,7-14H2,1-6H3.
What are the key properties of 2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine?
2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine has a molecular weight of 256.48 g/mol, XLogP of 4.06, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-3-N,2-dimethyldecane-2,3-diamine is sourced from PubChem (CID 79052772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).