2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol

C10H24N2O3 — CID 107852678

IUPAC2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol
SMILESCCN(CC)CCNC(CO)(CO)CO
InChIInChI=1S/C10H24N2O3/c1-3-12(4-2)6-5-11-10(7-13,8-14)9-15/h11,13-15H,3-9H2,1-2H3
InChIKeyUGIYZZREDFFWLU-UHFFFAOYSA-N
MW220.31 g/mol
LogP-1.37
Rot. Bonds9

About 2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol

2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol (PubChem CID 107852678) has the molecular formula C10H24N2O3 and a molecular weight of 220.31 g/mol. Its IUPAC name is 2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol.

Molecular Properties

Compound Name2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol
PubChem CID107852678
Molecular FormulaC10H24N2O3
Molecular Weight220.31 g/mol
Exact Mass220.18
IUPAC Name2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol
SMILESCCN(CC)CCNC(CO)(CO)CO
InChIInChI=1S/C10H24N2O3/c1-3-12(4-2)6-5-11-10(7-13,8-14)9-15/h11,13-15H,3-9H2,1-2H3
InChIKeyUGIYZZREDFFWLU-UHFFFAOYSA-N
XLogP-1.37
TPSA75.96 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 5-1.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(diethylamino)ethylamino]-2-ethyl-4-methylhexan-1-ol
CID 61048423
N-tert-butyl-N',N'-diethylethane-1,2-diamine;molecular hydrogen
CID 142350039
2-[2-(diethylamino)ethylamino]-2-(4-fluorophenyl)propan-1-ol
CID 61049819
3-[2-(diethylamino)ethylamino]-2,2,3-trimethylbutanoic acid
CID 65265735
methyl 2-[2-(diethylamino)ethylamino]-2-methylpropanoate
CID 60994914
ethane;2-(hydroxymethyl)-2-(2-hydroxysulfanylethylamino)propane-1,3-diol
CID 163296526
N',N'-diethyl-N-methylethane-1,2-diamine;ethane
CID 142004273
N-(4-chloro-2-methylbutan-2-yl)-N',N'-diethylethane-1,2-diamine
CID 107913963
methyl 2-[2-(diethylamino)ethylamino]-2-methylbutanoate
CID 60994649
2-[2-(diethylamino)ethylamino]-3-methoxy-2-phenylpropan-1-ol
CID 103465829
2-[2-(diethylamino)ethylamino]-2-(4-methoxyphenyl)butan-1-ol
CID 61048016
2-(4-chlorophenyl)-2-cyclopropyl-2-[2-(diethylamino)ethylamino]ethanol
CID 61047828

Frequently Asked Questions

What is the IUPAC name of 2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol?
The IUPAC name of 2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol (CID 107852678) is 2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol.
What is the SMILES notation for 2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol?
The canonical SMILES for 2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol is CCN(CC)CCNC(CO)(CO)CO.
What is the InChIKey of 2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol?
The InChIKey is UGIYZZREDFFWLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3/c1-3-12(4-2)6-5-11-10(7-13,8-14)9-15/h11,13-15H,3-9H2,1-2H3.
What are the key properties of 2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol?
2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol has a molecular weight of 220.31 g/mol, XLogP of -1.37, 9 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(diethylamino)ethylamino]-2-(hydroxymethyl)propane-1,3-diol is sourced from PubChem (CID 107852678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).