1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol

C10H24N2O3 — CID 648844

IUPAC1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol
SMILESCCNCC(O)COCC(O)CNCC
InChIInChI=1S/C10H24N2O3/c1-3-11-5-9(13)7-15-8-10(14)6-12-4-2/h9-14H,3-8H2,1-2H3
InChIKeyNOWSFZSRGQDPTC-UHFFFAOYSA-N
MW220.31 g/mol
LogP-1.06
Rot. Bonds10

About 1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol

1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol (PubChem CID 648844) has the molecular formula C10H24N2O3 and a molecular weight of 220.31 g/mol. Its IUPAC name is 1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol.

Molecular Properties

Compound Name1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol
PubChem CID648844
Molecular FormulaC10H24N2O3
Molecular Weight220.31 g/mol
Exact Mass220.18
IUPAC Name1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol
SMILESCCNCC(O)COCC(O)CNCC
InChIInChI=1S/C10H24N2O3/c1-3-11-5-9(13)7-15-8-10(14)6-12-4-2/h9-14H,3-8H2,1-2H3
InChIKeyNOWSFZSRGQDPTC-UHFFFAOYSA-N
XLogP-1.06
TPSA73.75 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 5-1.06
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol?
The IUPAC name of 1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol (CID 648844) is 1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol.
What is the SMILES notation for 1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol?
The canonical SMILES for 1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol is CCNCC(O)COCC(O)CNCC.
What is the InChIKey of 1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol?
The InChIKey is NOWSFZSRGQDPTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3/c1-3-11-5-9(13)7-15-8-10(14)6-12-4-2/h9-14H,3-8H2,1-2H3.
What are the key properties of 1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol?
1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol has a molecular weight of 220.31 g/mol, XLogP of -1.06, 10 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-3-[3-(ethylamino)-2-hydroxypropoxy]propan-2-ol is sourced from PubChem (CID 648844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).