1-(4-aminopiperidin-1-yl)prop-2-en-1-ol

C8H16N2O — CID 123311652

IUPAC1-(4-aminopiperidin-1-yl)prop-2-en-1-ol
SMILESC=CC(O)N1CCC(N)CC1
InChIInChI=1S/C8H16N2O/c1-2-8(11)10-5-3-7(9)4-6-10/h2,7-8,11H,1,3-6,9H2
InChIKeyUIVRWNULGRHDHP-UHFFFAOYSA-N
MW156.23 g/mol
LogP-0.09
Rot. Bonds2

About 1-(4-aminopiperidin-1-yl)prop-2-en-1-ol

1-(4-aminopiperidin-1-yl)prop-2-en-1-ol (PubChem CID 123311652) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 1-(4-aminopiperidin-1-yl)prop-2-en-1-ol.

Molecular Properties

Compound Name1-(4-aminopiperidin-1-yl)prop-2-en-1-ol
PubChem CID123311652
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name1-(4-aminopiperidin-1-yl)prop-2-en-1-ol
SMILESC=CC(O)N1CCC(N)CC1
InChIInChI=1S/C8H16N2O/c1-2-8(11)10-5-3-7(9)4-6-10/h2,7-8,11H,1,3-6,9H2
InChIKeyUIVRWNULGRHDHP-UHFFFAOYSA-N
XLogP-0.09
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.09
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

Piperidine;prop-2-en-1-ol
CID 118523561
1-(2-Amino-6-azaspiro[2.5]octan-6-yl)prop-2-en-1-ol
CID 135255484
2-[(1-Prop-2-enylpiperidin-4-yl)amino]ethanol
CID 142143543
1-[(3S)-3-methylpiperazin-1-yl]prop-2-en-1-ol
CID 170283445
(E)-4-(piperidin-3-ylamino)but-2-en-1-ol
CID 115013772
(E)-4-(piperidin-4-ylamino)but-2-en-1-ol
CID 115013773
(E)-4-[(1-methylpiperidin-3-yl)amino]but-2-en-1-ol
CID 115016774
(E)-4-[(1-methylpiperidin-4-yl)amino]but-2-en-1-ol
CID 115016775
4-[(1-Prop-2-enylpiperidin-4-yl)amino]pentan-1-ol
CID 115971876
2-[2-(4-Aminopiperidin-1-yl)ethyl-prop-2-enylamino]ethanol
CID 116300488
2-[3-Aminopentyl(prop-2-enyl)amino]ethanol
CID 116300632
2-[(1-Prop-2-enylpiperidin-3-yl)amino]ethanol
CID 117004938

Frequently Asked Questions

What is the IUPAC name of 1-(4-aminopiperidin-1-yl)prop-2-en-1-ol?
The IUPAC name of 1-(4-aminopiperidin-1-yl)prop-2-en-1-ol (CID 123311652) is 1-(4-aminopiperidin-1-yl)prop-2-en-1-ol.
What is the SMILES notation for 1-(4-aminopiperidin-1-yl)prop-2-en-1-ol?
The canonical SMILES for 1-(4-aminopiperidin-1-yl)prop-2-en-1-ol is C=CC(O)N1CCC(N)CC1.
What is the InChIKey of 1-(4-aminopiperidin-1-yl)prop-2-en-1-ol?
The InChIKey is UIVRWNULGRHDHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-2-8(11)10-5-3-7(9)4-6-10/h2,7-8,11H,1,3-6,9H2.
What are the key properties of 1-(4-aminopiperidin-1-yl)prop-2-en-1-ol?
1-(4-aminopiperidin-1-yl)prop-2-en-1-ol has a molecular weight of 156.23 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminopiperidin-1-yl)prop-2-en-1-ol is sourced from PubChem (CID 123311652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).