N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine

C7H18N2O — CID 123765079

IUPACN'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine
SMILESCC(C)(C)OCNCCN
InChIInChI=1S/C7H18N2O/c1-7(2,3)10-6-9-5-4-8/h9H,4-6,8H2,1-3H3
InChIKeyUDCKTGJQJOJQQL-UHFFFAOYSA-N
MW146.23 g/mol
LogP0.31
Rot. Bonds4

About N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine

N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine (PubChem CID 123765079) has the molecular formula C7H18N2O and a molecular weight of 146.23 g/mol. Its IUPAC name is N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine
PubChem CID123765079
Molecular FormulaC7H18N2O
Molecular Weight146.23 g/mol
Exact Mass146.14
IUPAC NameN'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine
SMILESCC(C)(C)OCNCCN
InChIInChI=1S/C7H18N2O/c1-7(2,3)10-6-9-5-4-8/h9H,4-6,8H2,1-3H3
InChIKeyUDCKTGJQJOJQQL-UHFFFAOYSA-N
XLogP0.31
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-[(2-methylpropan-2-yl)oxymethylamino]propanamide
CID 130284943
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;2-hydroperoxy-2-methylpropane
CID 161199167
N'-(2,2-dimethylpropyl)ethane-1,2-diamine
CID 61168060
4-[(2-methylpropan-2-yl)oxy]butan-1-amine
CID 18672802
CID 18520345
CID 18520345
tert-butyl N-[(2-aminoethylamino)methyl]carbamate
CID 170030361
N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine;N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;N'-(2-aminoethyl)ethane-1,2-diamine
CID 159410169
N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine
CID 5565
N'-(2-aminoethyl)-4,4-dimethylheptane-1,7-diamine
CID 57136754
N-[2-(2-aminoethylamino)ethyl]-N-[(2-methylpropan-2-yl)oxy]formamide
CID 141115607
N-[(2-methylpropan-2-yl)oxymethyl]propan-2-amine;propan-2-amine
CID 165393971
N'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine;pentahydrochloride
CID 10150970

Frequently Asked Questions

What is the IUPAC name of N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine?
The IUPAC name of N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine (CID 123765079) is N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine?
The canonical SMILES for N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine is CC(C)(C)OCNCCN.
What is the InChIKey of N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine?
The InChIKey is UDCKTGJQJOJQQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O/c1-7(2,3)10-6-9-5-4-8/h9H,4-6,8H2,1-3H3.
What are the key properties of N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine?
N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine has a molecular weight of 146.23 g/mol, XLogP of 0.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(2-methylpropan-2-yl)oxymethyl]ethane-1,2-diamine is sourced from PubChem (CID 123765079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).