1-piperazin-1-ylprop-2-en-1-ol

C7H14N2O — CID 66821299

IUPAC1-piperazin-1-ylprop-2-en-1-ol
SMILESC=CC(O)N1CCNCC1
InChIInChI=1S/C7H14N2O/c1-2-7(10)9-5-3-8-4-6-9/h2,7-8,10H,1,3-6H2
InChIKeyGUARPRULMKFTPY-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.60
Rot. Bonds2

About 1-piperazin-1-ylprop-2-en-1-ol

1-piperazin-1-ylprop-2-en-1-ol (PubChem CID 66821299) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 1-piperazin-1-ylprop-2-en-1-ol.

Molecular Properties

Compound Name1-piperazin-1-ylprop-2-en-1-ol
PubChem CID66821299
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name1-piperazin-1-ylprop-2-en-1-ol
SMILESC=CC(O)N1CCNCC1
InChIInChI=1S/C7H14N2O/c1-2-7(10)9-5-3-8-4-6-9/h2,7-8,10H,1,3-6H2
InChIKeyGUARPRULMKFTPY-UHFFFAOYSA-N
XLogP-0.60
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-piperazin-1-ylbut-3-enoic acid
CID 130492255
2-piperazin-1-ylbut-3-enenitrile
CID 70379687
4-[(1S)-1-piperazin-1-ylprop-2-enyl]phenol
CID 131631160
2-[(1R)-1-piperazin-1-ylprop-2-enyl]phenol
CID 131622980
morpholine;1-piperazin-1-ylethanol
CID 67676153
1,6-di(piperazin-1-yl)hexane-1,2,5,6-tetrol
CID 70614432
methoxy(piperazin-1-yl)methanol
CID 154545795
1-[(1S)-1-(2,3,4,5,6-pentamethylphenyl)prop-2-enyl]piperazine;dihydrochloride
CID 171282351
2,2,2-tribromo-1-[4-(1-hydroxyprop-2-enyl)piperazin-1-yl]ethanone
CID 21040703
2,6-diiodo-4-[(1R)-1-piperazin-1-ylprop-2-enyl]phenol
CID 171296483
2,2-di(piperazin-1-yl)acetaldehyde
CID 87096321
1-[(1R)-1-(3,5-dichlorophenyl)prop-2-enyl]piperazine
CID 171288389

Frequently Asked Questions

What is the IUPAC name of 1-piperazin-1-ylprop-2-en-1-ol?
The IUPAC name of 1-piperazin-1-ylprop-2-en-1-ol (CID 66821299) is 1-piperazin-1-ylprop-2-en-1-ol.
What is the SMILES notation for 1-piperazin-1-ylprop-2-en-1-ol?
The canonical SMILES for 1-piperazin-1-ylprop-2-en-1-ol is C=CC(O)N1CCNCC1.
What is the InChIKey of 1-piperazin-1-ylprop-2-en-1-ol?
The InChIKey is GUARPRULMKFTPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-2-7(10)9-5-3-8-4-6-9/h2,7-8,10H,1,3-6H2.
What are the key properties of 1-piperazin-1-ylprop-2-en-1-ol?
1-piperazin-1-ylprop-2-en-1-ol has a molecular weight of 142.20 g/mol, XLogP of -0.60, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperazin-1-ylprop-2-en-1-ol is sourced from PubChem (CID 66821299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).