2-Diisopropylaminoethanol

C8H19NO — CID 7313

IUPAC2-[di(propan-2-yl)amino]ethanol
SMILESCC(C)N(CCO)C(C)C
InChIInChI=1S/C8H19NO/c1-7(2)9(5-6-10)8(3)4/h7-8,10H,5-6H2,1-4H3
InChIKeyZYWUVGFIXPNBDL-UHFFFAOYSA-N
MW145.24 g/mol
LogP1.20
Rot. Bonds4

About 2-Diisopropylaminoethanol

2-Diisopropylaminoethanol (PubChem CID 7313) has the molecular formula C8H19NO and a molecular weight of 145.24 g/mol. Its IUPAC name is 2-[di(propan-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-Diisopropylaminoethanol
PubChem CID7313
Molecular FormulaC8H19NO
Molecular Weight145.24 g/mol
Exact Mass145.15
IUPAC Name2-[di(propan-2-yl)amino]ethanol
SMILESCC(C)N(CCO)C(C)C
InChIInChI=1S/C8H19NO/c1-7(2)9(5-6-10)8(3)4/h7-8,10H,5-6H2,1-4H3
InChIKeyZYWUVGFIXPNBDL-UHFFFAOYSA-N
XLogP1.20
TPSA23.50 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity73

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.24
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Dibutylamino)ethanol
CID 7621
N-Butyldiethanolamine
CID 7620
tert-Butyldiethanolamine
CID 62430
Ethanaminium, N,N,N-triethyl-2-hydroxy-, iodide (1:1)
CID 80057
Isopropyldiethanolamine
CID 8498
1-Propanol, 2-(dimethylamino)-
CID 85865
Ethanaminium, N,N,N-triethyl-2-hydroxy-, chloride (1:1)
CID 198804
Ethanol, 2,2'-(propylimino)bis-
CID 42848
2-(Dipropylamino)ethanol
CID 76721
3-[Di(propan-2-yl)amino]propan-1-ol
CID 295957
2-(Diethylamino)propan-1-ol
CID 136408
1-(Dipropylamino)propan-2-ol
CID 99000

Frequently Asked Questions

What is the IUPAC name of 2-Diisopropylaminoethanol?
The IUPAC name of 2-Diisopropylaminoethanol (CID 7313) is 2-[di(propan-2-yl)amino]ethanol.
What is the SMILES notation for 2-Diisopropylaminoethanol?
The canonical SMILES for 2-Diisopropylaminoethanol is CC(C)N(CCO)C(C)C.
What is the InChIKey of 2-Diisopropylaminoethanol?
The InChIKey is ZYWUVGFIXPNBDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-7(2)9(5-6-10)8(3)4/h7-8,10H,5-6H2,1-4H3.
What are the key properties of 2-Diisopropylaminoethanol?
2-Diisopropylaminoethanol has a molecular weight of 145.24 g/mol, XLogP of 1.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Diisopropylaminoethanol is sourced from PubChem (CID 7313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).