N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane

C11H28N2 — CID 142350934

IUPACN'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane
SMILESCCC.CCN(C)CCCN(C)C
InChIInChI=1S/C8H20N2.C3H8/c1-5-10(4)8-6-7-9(2)3;1-3-2/h5-8H2,1-4H3;3H2,1-2H3
InChIKeyQHGPFDYCHMQDPM-UHFFFAOYSA-N
MW188.36 g/mol
LogP2.31
Rot. Bonds5

About N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane

N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane (PubChem CID 142350934) has the molecular formula C11H28N2 and a molecular weight of 188.36 g/mol. Its IUPAC name is N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane.

Molecular Properties

Compound NameN'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane
PubChem CID142350934
Molecular FormulaC11H28N2
Molecular Weight188.36 g/mol
Exact Mass188.23
IUPAC NameN'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane
SMILESCCC.CCN(C)CCCN(C)C
InChIInChI=1S/C8H20N2.C3H8/c1-5-10(4)8-6-7-9(2)3;1-3-2/h5-8H2,1-4H3;3H2,1-2H3
InChIKeyQHGPFDYCHMQDPM-UHFFFAOYSA-N
XLogP2.31
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.36
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N'-[3-(dimethylamino)propyl]-N,N,N'-trimethylpropane-1,3-diamine;ethane
CID 171793143
N,N,N'-trimethyl-N'-[3-[methyl(propyl)amino]propyl]propane-1,3-diamine
CID 20621536
N'-[3-(dimethylamino)propyl]-N,N,N'-trimethylbutane-1,4-diamine;trihydrochloride
CID 131875706
7-(dimethylamino)-N-[3-[ethyl(methyl)amino]propyl]-N-methylheptanamide
CID 168959154
N,N'-bis[2-(dimethylamino)ethyl]-N,N'-dimethylpropane-1,3-diamine
CID 547219
N,N'-diethyl-N,N'-dimethylbutane-1,4-diamine;N-ethyl-N,N'-dimethyl-N'-pentylbutane-1,4-diamine;hexane
CID 160540999
N-[3-[3-(dimethylamino)propyl-methylamino]propyl]-N-methylhydroxylamine
CID 176937078
N-ethyl-N-methyltridecan-1-amine
CID 71442842
ethane;N-ethyl-N-methylpentan-1-amine
CID 142145247
N,N-dimethylpropan-1-amine;N-ethyl-N-methylethanamine
CID 118123590
N-ethyl-N-methyloctadecan-1-amine;hydrochloride
CID 174373981
N,N-dimethyloctan-1-amine;N-dodecyl-N-methyldodecan-1-amine
CID 23134819

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane?
The IUPAC name of N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane (CID 142350934) is N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane.
What is the SMILES notation for N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane?
The canonical SMILES for N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane is CCC.CCN(C)CCCN(C)C.
What is the InChIKey of N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane?
The InChIKey is QHGPFDYCHMQDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2.C3H8/c1-5-10(4)8-6-7-9(2)3;1-3-2/h5-8H2,1-4H3;3H2,1-2H3.
What are the key properties of N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane?
N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane has a molecular weight of 188.36 g/mol, XLogP of 2.31, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N,N,N'-trimethylpropane-1,3-diamine;propane is sourced from PubChem (CID 142350934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).