Ethanol, 2,2'-(propylimino)bis-

C7H17NO2 — CID 42848

IUPAC2-[2-hydroxyethyl(propyl)amino]ethanol
SMILESCCCN(CCO)CCO
InChIInChI=1S/C7H17NO2/c1-2-3-8(4-6-9)5-7-10/h9-10H,2-7H2,1H3
InChIKeyOZICRFXCUVKDRG-UHFFFAOYSA-N
MW147.22 g/mol
LogP-0.20
Rot. Bonds6

About Ethanol, 2,2'-(propylimino)bis-

Ethanol, 2,2'-(propylimino)bis- (PubChem CID 42848) has the molecular formula C7H17NO2 and a molecular weight of 147.22 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(propyl)amino]ethanol.

Molecular Properties

Compound NameEthanol, 2,2'-(propylimino)bis-
PubChem CID42848
Molecular FormulaC7H17NO2
Molecular Weight147.22 g/mol
Exact Mass147.13
IUPAC Name2-[2-hydroxyethyl(propyl)amino]ethanol
SMILESCCCN(CCO)CCO
InChIInChI=1S/C7H17NO2/c1-2-3-8(4-6-9)5-7-10/h9-10H,2-7H2,1H3
InChIKeyOZICRFXCUVKDRG-UHFFFAOYSA-N
XLogP-0.20
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity62

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Triethanolamine
CID 7618
Diethylethanolamine
CID 7497
N-Methyldiethanolamine
CID 7767
Triisopropanolamine
CID 24730
Choline, hydroxide
CID 31255
2-(Dibutylamino)ethanol
CID 7621
Ethyldiethanolamine
CID 8769
N-Butyldiethanolamine
CID 7620
2-Diisopropylaminoethanol
CID 7313
tert-Butyldiethanolamine
CID 62430
Triethanolamine hydrochloride
CID 101814
Isopropyldiethanolamine
CID 8498

Frequently Asked Questions

What is the IUPAC name of Ethanol, 2,2'-(propylimino)bis-?
The IUPAC name of Ethanol, 2,2'-(propylimino)bis- (CID 42848) is 2-[2-hydroxyethyl(propyl)amino]ethanol.
What is the SMILES notation for Ethanol, 2,2'-(propylimino)bis-?
The canonical SMILES for Ethanol, 2,2'-(propylimino)bis- is CCCN(CCO)CCO.
What is the InChIKey of Ethanol, 2,2'-(propylimino)bis-?
The InChIKey is OZICRFXCUVKDRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO2/c1-2-3-8(4-6-9)5-7-10/h9-10H,2-7H2,1H3.
What are the key properties of Ethanol, 2,2'-(propylimino)bis-?
Ethanol, 2,2'-(propylimino)bis- has a molecular weight of 147.22 g/mol, XLogP of -0.20, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for Ethanol, 2,2'-(propylimino)bis- is sourced from PubChem (CID 42848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).