3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol

C10H24N2O2 — CID 14043735

IUPAC3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol
SMILESCN(CCCO)CCN(C)CCCO
InChIInChI=1S/C10H24N2O2/c1-11(5-3-9-13)7-8-12(2)6-4-10-14/h13-14H,3-10H2,1-2H3
InChIKeyUFRWBZWQHYFZCM-UHFFFAOYSA-N
MW204.31 g/mol
LogP-0.39
Rot. Bonds9

About 3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol

3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol (PubChem CID 14043735) has the molecular formula C10H24N2O2 and a molecular weight of 204.31 g/mol. Its IUPAC name is 3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol.

Molecular Properties

Compound Name3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol
PubChem CID14043735
Molecular FormulaC10H24N2O2
Molecular Weight204.31 g/mol
Exact Mass204.18
IUPAC Name3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol
SMILESCN(CCCO)CCN(C)CCCO
InChIInChI=1S/C10H24N2O2/c1-11(5-3-9-13)7-8-12(2)6-4-10-14/h13-14H,3-10H2,1-2H3
InChIKeyUFRWBZWQHYFZCM-UHFFFAOYSA-N
XLogP-0.39
TPSA46.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(Diethylamino)-1-propanol
CID 12159
1-Propanol, 3-(dibutylamino)-
CID 74905
3-(4-Methyl-1-piperazine)propan-1-ol
CID 79208
1,4-Piperazinedipropanol
CID 261286
1-Propanol, 3-(dipropylamino)-
CID 214730
Tripropanolamine
CID 9794123
3-[4-(2-Hydroxyethyl)piperazin-1-yl]propan-1-ol
CID 342524
3-((2-(Dimethylamino)ethyl)(methyl)amino)propan-1-ol
CID 547315
3,3'-(Methylazanediyl)bis(propan-1-ol)
CID 228352
2-[2-[1-(Hydroxymethyl)propyl-methyl-amino]ethyl-methyl-amino]butan-1-ol
CID 469922
3,3',3'',3'''-(((3-Hydroxypropyl)imino)bis(ethylenenitrilo))tetrapropanol
CID 88067
tetrahydro-1H-1,4-diazepine-1,4(5H)-dipropanol
CID 88322

Frequently Asked Questions

What is the IUPAC name of 3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol?
The IUPAC name of 3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol (CID 14043735) is 3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol.
What is the SMILES notation for 3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol?
The canonical SMILES for 3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol is CN(CCCO)CCN(C)CCCO.
What is the InChIKey of 3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol?
The InChIKey is UFRWBZWQHYFZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2/c1-11(5-3-9-13)7-8-12(2)6-4-10-14/h13-14H,3-10H2,1-2H3.
What are the key properties of 3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol?
3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol has a molecular weight of 204.31 g/mol, XLogP of -0.39, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[3-hydroxypropyl(methyl)amino]ethyl-methylamino]propan-1-ol is sourced from PubChem (CID 14043735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).