N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine

C11H26N2O — CID 112588432

IUPACN',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine
SMILESCC(CN)CN(C)CCOC(C)(C)C
InChIInChI=1S/C11H26N2O/c1-10(8-12)9-13(5)6-7-14-11(2,3)4/h10H,6-9,12H2,1-5H3
InChIKeyMKZOGILGFKGELI-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.33
Rot. Bonds6

About N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine

N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine (PubChem CID 112588432) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine.

Molecular Properties

Compound NameN',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine
PubChem CID112588432
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC NameN',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine
SMILESCC(CN)CN(C)CCOC(C)(C)C
InChIInChI=1S/C11H26N2O/c1-10(8-12)9-13(5)6-7-14-11(2,3)4/h10H,6-9,12H2,1-5H3
InChIKeyMKZOGILGFKGELI-UHFFFAOYSA-N
XLogP1.33
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-1-[methyl-[2-[(2-methylpropan-2-yl)oxy]ethyl]amino]propan-2-ol
CID 111336122
N'-ethyl-N',2-dimethylpropane-1,3-diamine
CID 25219171
N-tert-butyl-2-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]propan-2-amine
CID 122631646
N-(2-ethoxyethyl)-N,2-dimethylbutane-1,4-diamine
CID 81055341
N',2-dimethyl-N'-(2-methylbutyl)propane-1,3-diamine
CID 43295447
N',2-dimethyl-N'-(2-methylpropyl)butane-1,4-diamine
CID 81080701
N',2-dimethyl-N'-(2-methylbutan-2-yl)propane-1,3-diamine
CID 63981166
N-(2-ethoxyethyl)-N,2-dimethylpentane-1,5-diamine
CID 104682346
N',2-dimethyl-N'-[2-(1-methylpiperidin-4-yl)ethyl]propane-1,3-diamine
CID 115198906
2-methyl-3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propan-1-amine
CID 112588403
N',2-dimethyl-N'-(3-methylsulfonylpropyl)propane-1,3-diamine
CID 63190976
N',2-dimethyl-N'-(2-methylbutan-2-yl)butane-1,4-diamine
CID 81080379

Frequently Asked Questions

What is the IUPAC name of N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine?
The IUPAC name of N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine (CID 112588432) is N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine.
What is the SMILES notation for N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine?
The canonical SMILES for N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine is CC(CN)CN(C)CCOC(C)(C)C.
What is the InChIKey of N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine?
The InChIKey is MKZOGILGFKGELI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-10(8-12)9-13(5)6-7-14-11(2,3)4/h10H,6-9,12H2,1-5H3.
What are the key properties of N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine?
N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine has a molecular weight of 202.34 g/mol, XLogP of 1.33, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',2-dimethyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]propane-1,3-diamine is sourced from PubChem (CID 112588432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).