1-(4-propylpiperazin-1-yl)pentan-2-ol

C12H26N2O — CID 62043435

IUPAC1-(4-propylpiperazin-1-yl)pentan-2-ol
SMILESCCCC(O)CN1CCN(CCC)CC1
InChIInChI=1S/C12H26N2O/c1-3-5-12(15)11-14-9-7-13(6-4-2)8-10-14/h12,15H,3-11H2,1-2H3
InChIKeyBGGUGNIMJFBNQK-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.17
Rot. Bonds6

About 1-(4-propylpiperazin-1-yl)pentan-2-ol

1-(4-propylpiperazin-1-yl)pentan-2-ol (PubChem CID 62043435) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 1-(4-propylpiperazin-1-yl)pentan-2-ol.

Molecular Properties

Compound Name1-(4-propylpiperazin-1-yl)pentan-2-ol
PubChem CID62043435
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name1-(4-propylpiperazin-1-yl)pentan-2-ol
SMILESCCCC(O)CN1CCN(CCC)CC1
InChIInChI=1S/C12H26N2O/c1-3-5-12(15)11-14-9-7-13(6-4-2)8-10-14/h12,15H,3-11H2,1-2H3
InChIKeyBGGUGNIMJFBNQK-UHFFFAOYSA-N
XLogP1.17
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-1-(4-propylpiperazin-1-yl)pentan-2-amine
CID 93255682
1-amino-4-(4-propylpiperazin-1-yl)butan-2-ol
CID 64820693
1-butoxy-3-(4-propylpiperazin-1-yl)propan-2-ol
CID 107263711
1-(8-azaspiro[4.5]decan-8-yl)pentan-2-ol
CID 63158943
1-[4-(3-methylbutyl)piperazin-1-yl]butan-2-ol
CID 58721625
1-(4-tert-butylpiperidin-1-yl)pentan-2-ol
CID 62090229
1-(iodomethylamino)-2-(4-propylpiperazin-1-yl)ethanol
CID 167232293
1-(2-methoxyethylamino)-3-(4-propylpiperazin-1-yl)propan-2-ol
CID 113317417
1-[10-(2-hydroxypropyl)-7-propyl-1-oxa-4,7,10-triazacyclododec-4-yl]propan-2-ol
CID 142476457
(4S)-9-(4-methylpiperazin-1-yl)nonan-4-ol
CID 144712129
1-[4-(3-methylphenyl)piperazin-1-yl]pentan-2-ol
CID 62044767
1-[4-[2-[2-[2-[bis(2-hydroxydodecyl)amino]ethyl-(2-hydroxydodecyl)amino]ethyl-(2-hydroxydodecyl)amino]ethyl]piperazin-1-yl]dodecan-2-ol
CID 46901149

Frequently Asked Questions

What is the IUPAC name of 1-(4-propylpiperazin-1-yl)pentan-2-ol?
The IUPAC name of 1-(4-propylpiperazin-1-yl)pentan-2-ol (CID 62043435) is 1-(4-propylpiperazin-1-yl)pentan-2-ol.
What is the SMILES notation for 1-(4-propylpiperazin-1-yl)pentan-2-ol?
The canonical SMILES for 1-(4-propylpiperazin-1-yl)pentan-2-ol is CCCC(O)CN1CCN(CCC)CC1.
What is the InChIKey of 1-(4-propylpiperazin-1-yl)pentan-2-ol?
The InChIKey is BGGUGNIMJFBNQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-3-5-12(15)11-14-9-7-13(6-4-2)8-10-14/h12,15H,3-11H2,1-2H3.
What are the key properties of 1-(4-propylpiperazin-1-yl)pentan-2-ol?
1-(4-propylpiperazin-1-yl)pentan-2-ol has a molecular weight of 214.35 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-propylpiperazin-1-yl)pentan-2-ol is sourced from PubChem (CID 62043435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).