1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol

C13H29N3O — CID 54773428

IUPAC1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol
SMILESCCCN(CCC)CC(O)CN1CCNCC1
InChIInChI=1S/C13H29N3O/c1-3-7-15(8-4-2)11-13(17)12-16-9-5-14-6-10-16/h13-14,17H,3-12H2,1-2H3
InChIKeyNDRODSOEEWDLKM-UHFFFAOYSA-N
MW243.39 g/mol
LogP0.37
Rot. Bonds8

About 1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol

1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol (PubChem CID 54773428) has the molecular formula C13H29N3O and a molecular weight of 243.39 g/mol. Its IUPAC name is 1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol
PubChem CID54773428
Molecular FormulaC13H29N3O
Molecular Weight243.39 g/mol
Exact Mass243.23
IUPAC Name1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol
SMILESCCCN(CCC)CC(O)CN1CCNCC1
InChIInChI=1S/C13H29N3O/c1-3-7-15(8-4-2)11-13(17)12-16-9-5-14-6-10-16/h13-14,17H,3-12H2,1-2H3
InChIKeyNDRODSOEEWDLKM-UHFFFAOYSA-N
XLogP0.37
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(dimethylamino)ethyl-propylamino]-3-piperazin-1-ylpropan-2-ol
CID 65448308
1-(1,4-diazepan-1-yl)-3-(dibutylamino)propan-2-ol
CID 54773490
(2S)-1-(1,4-diazepan-1-yl)-3-(diethylamino)propan-2-ol
CID 95067068
(2R)-1-(1,4-diazepan-1-yl)-3-(diethylamino)propan-2-ol
CID 95067069
7-[3-(didodecylamino)-2-hydroxypropyl]-1,4,7,10-tetrazacyclododecane-1-carbaldehyde
CID 11039349
1-[ethyl(2,2,2-trifluoroethyl)amino]-3-piperazin-1-ylpropan-2-ol
CID 65450385
1-[bis(2-methylpropyl)amino]-3-(1,4-diazepan-1-yl)propan-2-ol
CID 54773489
1-[pentyl(propan-2-yl)amino]-3-piperazin-1-ylpropan-2-ol
CID 65449253
1-[2-methoxyethyl(2-methylpropyl)amino]-3-piperazin-1-ylpropan-2-ol
CID 65448121
(2R)-1-piperazin-1-ylbutan-2-ol;dihydrochloride
CID 178200129
1-piperazin-1-ylheptan-2-ol
CID 70501156
piperazine;1-piperazin-1-ylpropan-2-ol
CID 174899588

Frequently Asked Questions

What is the IUPAC name of 1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol?
The IUPAC name of 1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol (CID 54773428) is 1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol.
What is the SMILES notation for 1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol?
The canonical SMILES for 1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol is CCCN(CCC)CC(O)CN1CCNCC1.
What is the InChIKey of 1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol?
The InChIKey is NDRODSOEEWDLKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O/c1-3-7-15(8-4-2)11-13(17)12-16-9-5-14-6-10-16/h13-14,17H,3-12H2,1-2H3.
What are the key properties of 1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol?
1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol has a molecular weight of 243.39 g/mol, XLogP of 0.37, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dipropylamino)-3-piperazin-1-ylpropan-2-ol is sourced from PubChem (CID 54773428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).