1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol

C8H20N2O — CID 79006123

IUPAC1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol
SMILESCCN(CCN)CC(C)(C)O
InChIInChI=1S/C8H20N2O/c1-4-10(6-5-9)7-8(2,3)11/h11H,4-7,9H2,1-3H3
InChIKeyUQWCWIDMAWKPCQ-UHFFFAOYSA-N
MW160.26 g/mol
LogP0.04
Rot. Bonds5

About 1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol

1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol (PubChem CID 79006123) has the molecular formula C8H20N2O and a molecular weight of 160.26 g/mol. Its IUPAC name is 1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol
PubChem CID79006123
Molecular FormulaC8H20N2O
Molecular Weight160.26 g/mol
Exact Mass160.16
IUPAC Name1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol
SMILESCCN(CCN)CC(C)(C)O
InChIInChI=1S/C8H20N2O/c1-4-10(6-5-9)7-8(2,3)11/h11H,4-7,9H2,1-3H3
InChIKeyUQWCWIDMAWKPCQ-UHFFFAOYSA-N
XLogP0.04
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.26
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[dodecyl(ethyl)amino]-2-methylpropan-2-ol
CID 79390324
1-[9-bromononyl(ethyl)amino]-2-methylpropan-2-ol
CID 105343823
5-[ethyl-(2-hydroxy-2-methylpropyl)amino]pentan-1-ol
CID 79047122
1-[ethyl(2-ethylsulfanylethyl)amino]-2-methylpropan-2-ol
CID 111462033
1-[2-aminoethyl(methyl)amino]-2-methylpropan-2-ol
CID 54431132
3-[ethyl-(2-hydroxy-2-methylpropyl)amino]propanimidamide
CID 79387749
5-[ethyl-(2-hydroxy-2-methylpropyl)amino]pentanethioamide
CID 79381978
1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol
CID 175894515
5-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2,2-dimethylpentanethioamide
CID 79380688
1-[ethyl-[2-(propan-2-ylamino)ethyl]amino]-2-methylpropan-2-ol
CID 79389739
N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine
CID 157466747
N'-(2-aminoethyl)-N'-[2-(diethylamino)ethyl]ethane-1,2-diamine
CID 107912667

Frequently Asked Questions

What is the IUPAC name of 1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol?
The IUPAC name of 1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol (CID 79006123) is 1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol is CCN(CCN)CC(C)(C)O.
What is the InChIKey of 1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol?
The InChIKey is UQWCWIDMAWKPCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O/c1-4-10(6-5-9)7-8(2,3)11/h11H,4-7,9H2,1-3H3.
What are the key properties of 1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol?
1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol has a molecular weight of 160.26 g/mol, XLogP of 0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol is sourced from PubChem (CID 79006123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).