4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine

C15H34N2 — CID 79062661

IUPAC4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine
SMILESCCNC(CCC(C)C)C(CC)(CC)N(C)C
InChIInChI=1S/C15H34N2/c1-8-15(9-2,17(6)7)14(16-10-3)12-11-13(4)5/h13-14,16H,8-12H2,1-7H3
InChIKeySNYXJBDKNDCHRR-UHFFFAOYSA-N
MW242.45 g/mol
LogP3.52
Rot. Bonds9

About 4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine

4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine (PubChem CID 79062661) has the molecular formula C15H34N2 and a molecular weight of 242.45 g/mol. Its IUPAC name is 4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine.

Molecular Properties

Compound Name4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine
PubChem CID79062661
Molecular FormulaC15H34N2
Molecular Weight242.45 g/mol
Exact Mass242.27
IUPAC Name4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine
SMILESCCNC(CCC(C)C)C(CC)(CC)N(C)C
InChIInChI=1S/C15H34N2/c1-8-15(9-2,17(6)7)14(16-10-3)12-11-13(4)5/h13-14,16H,8-12H2,1-7H3
InChIKeySNYXJBDKNDCHRR-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.45
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-4-hydrazinyl-N,N,8-trimethylnonan-3-amine
CID 105241898
3-ethyl-3-N,3-N,4-N,6-tetramethylheptane-3,4-diamine
CID 79062379
3-ethyl-3-N,3-N,4-N-trimethylheptane-3,4-diamine
CID 79062384
3-ethyl-3-N,3-N-dimethyl-4-N-propyloctane-3,4-diamine
CID 79061055
N,3-diethyl-7-methyl-3-phenyloctan-4-amine
CID 63417594
1-(3,5-difluorophenyl)-2-N,3-diethyl-3-N,3-N-dimethylpentane-2,3-diamine
CID 105406535
3-ethyl-3-N,3-N-dimethyl-4-N-propylnon-8-ene-3,4-diamine
CID 79061629
3-ethyl-2-N,3-N,3-N-trimethyl-1-propan-2-yloxypentane-2,3-diamine
CID 79568715
3-ethyl-3-N,3-N-dimethyl-4-N-propyloct-7-yne-3,4-diamine
CID 79061768
3-ethyl-3-N,3-N,4-N-trimethyloct-7-ene-3,4-diamine
CID 79062164
N-ethyl-2,8-dimethylnonan-5-amine
CID 62603927
N-ethyl-5-methylhexan-2-amine
CID 24689543

Frequently Asked Questions

What is the IUPAC name of 4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine?
The IUPAC name of 4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine (CID 79062661) is 4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine.
What is the SMILES notation for 4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine?
The canonical SMILES for 4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine is CCNC(CCC(C)C)C(CC)(CC)N(C)C.
What is the InChIKey of 4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine?
The InChIKey is SNYXJBDKNDCHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N2/c1-8-15(9-2,17(6)7)14(16-10-3)12-11-13(4)5/h13-14,16H,8-12H2,1-7H3.
What are the key properties of 4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine?
4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine has a molecular weight of 242.45 g/mol, XLogP of 3.52, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,3-diethyl-3-N,3-N,7-trimethyloctane-3,4-diamine is sourced from PubChem (CID 79062661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).