N',N',2-triethyl-N-methylpentane-1,5-diamine

C12H28N2 — CID 142375045

IUPACN',N',2-triethyl-N-methylpentane-1,5-diamine
SMILESCCC(CCCN(CC)CC)CNC
InChIInChI=1S/C12H28N2/c1-5-12(11-13-4)9-8-10-14(6-2)7-3/h12-13H,5-11H2,1-4H3
InChIKeyOVQZCSRSXXOOHX-UHFFFAOYSA-N
MW200.37 g/mol
LogP2.35
Rot. Bonds9

About N',N',2-triethyl-N-methylpentane-1,5-diamine

N',N',2-triethyl-N-methylpentane-1,5-diamine (PubChem CID 142375045) has the molecular formula C12H28N2 and a molecular weight of 200.37 g/mol. Its IUPAC name is N',N',2-triethyl-N-methylpentane-1,5-diamine.

Molecular Properties

Compound NameN',N',2-triethyl-N-methylpentane-1,5-diamine
PubChem CID142375045
Molecular FormulaC12H28N2
Molecular Weight200.37 g/mol
Exact Mass200.23
IUPAC NameN',N',2-triethyl-N-methylpentane-1,5-diamine
SMILESCCC(CCCN(CC)CC)CNC
InChIInChI=1S/C12H28N2/c1-5-12(11-13-4)9-8-10-14(6-2)7-3/h12-13H,5-11H2,1-4H3
InChIKeyOVQZCSRSXXOOHX-UHFFFAOYSA-N
XLogP2.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.37
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-6-(diethylamino)-3-ethylhexan-1-ol
CID 118889911
N'-[3-(diethylamino)propyl]-N',3-diethylhexane-1,6-diamine
CID 102994441
7-(diethylamino)-3-ethylheptan-1-ol
CID 144711867
2-ethyl-N-methylundecan-1-amine
CID 63522579
ethane;2-ethyl-N-methylbutan-1-amine
CID 143337044
(5R)-N,N,5-triethyl-7-methoxyheptan-1-amine
CID 118890299
2-ethyl-N-methylpentan-1-amine;propane
CID 143462607
1-N,1-N-diethylhexane-1,4-diamine
CID 86612309
3-[3-(diethylamino)propyl]pentadecan-1-ol
CID 118181955
N'-ethyl-N-methyl-N'-(4-methylpentyl)ethane-1,2-diamine
CID 134316858
4-ethyl-N,N-dipropyldodecan-1-amine
CID 174349455
ethane;2-ethyl-N'-methylpropane-1,3-diamine
CID 144511427

Frequently Asked Questions

What is the IUPAC name of N',N',2-triethyl-N-methylpentane-1,5-diamine?
The IUPAC name of N',N',2-triethyl-N-methylpentane-1,5-diamine (CID 142375045) is N',N',2-triethyl-N-methylpentane-1,5-diamine.
What is the SMILES notation for N',N',2-triethyl-N-methylpentane-1,5-diamine?
The canonical SMILES for N',N',2-triethyl-N-methylpentane-1,5-diamine is CCC(CCCN(CC)CC)CNC.
What is the InChIKey of N',N',2-triethyl-N-methylpentane-1,5-diamine?
The InChIKey is OVQZCSRSXXOOHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2/c1-5-12(11-13-4)9-8-10-14(6-2)7-3/h12-13H,5-11H2,1-4H3.
What are the key properties of N',N',2-triethyl-N-methylpentane-1,5-diamine?
N',N',2-triethyl-N-methylpentane-1,5-diamine has a molecular weight of 200.37 g/mol, XLogP of 2.35, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N',2-triethyl-N-methylpentane-1,5-diamine is sourced from PubChem (CID 142375045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).