N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine

C11H27N3 — CID 28572535

IUPACN'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine
SMILESCN(C)CCNCC(C)(C)CN(C)C
InChIInChI=1S/C11H27N3/c1-11(2,10-14(5)6)9-12-7-8-13(3)4/h12H,7-10H2,1-6H3
InChIKeyNLPYXMCCHUGIQH-UHFFFAOYSA-N
MW201.36 g/mol
LogP0.73
Rot. Bonds7

About N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine

N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine (PubChem CID 28572535) has the molecular formula C11H27N3 and a molecular weight of 201.36 g/mol. Its IUPAC name is N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine
PubChem CID28572535
Molecular FormulaC11H27N3
Molecular Weight201.36 g/mol
Exact Mass201.22
IUPAC NameN'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine
SMILESCN(C)CCNCC(C)(C)CN(C)C
InChIInChI=1S/C11H27N3/c1-11(2,10-14(5)6)9-12-7-8-13(3)4/h12H,7-10H2,1-6H3
InChIKeyNLPYXMCCHUGIQH-UHFFFAOYSA-N
XLogP0.73
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.36
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(dimethylamino)-3-[2-(dimethylamino)ethylamino]-2-methylpropan-2-ol
CID 106147764
N,N,2,2-tetramethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine
CID 112588610
N'-hexyl-N,N,2,2-tetramethylpropane-1,3-diamine
CID 28879474
1-N-[2-(dimethylamino)ethyl]-2-methylpropane-1,2-diamine
CID 59355176
N'-(3-ethoxypropyl)-N,N,2,2-tetramethylpropane-1,3-diamine
CID 65176530
3-[4-(dimethylamino)butylamino]-2,2-dimethylpropan-1-ol
CID 81412054
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
CID 28572507
3-[[2-(dimethylamino)ethylamino]methyl]pentan-3-ol
CID 65111554
N,N,2,2-tetramethyl-N'-(3-phenoxypropyl)propane-1,3-diamine
CID 60688858
(2S)-3-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]propane-1,2-diol
CID 61142642
5-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-4,4-dimethylpentanenitrile
CID 115651171
N-ethyl-N',N'-dimethylethane-1,2-diamine;1,1,1-trifluoroethane
CID 143427394

Frequently Asked Questions

What is the IUPAC name of N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine?
The IUPAC name of N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine (CID 28572535) is N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine.
What is the SMILES notation for N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine?
The canonical SMILES for N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine is CN(C)CCNCC(C)(C)CN(C)C.
What is the InChIKey of N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine?
The InChIKey is NLPYXMCCHUGIQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27N3/c1-11(2,10-14(5)6)9-12-7-8-13(3)4/h12H,7-10H2,1-6H3.
What are the key properties of N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine?
N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine has a molecular weight of 201.36 g/mol, XLogP of 0.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(dimethylamino)ethyl]-N,N,2,2-tetramethylpropane-1,3-diamine is sourced from PubChem (CID 28572535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).