(Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol

C11H21NO — CID 117265989

IUPAC(Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol
SMILESCC(C)N1CCC(/C=C\CO)CC1
InChIInChI=1S/C11H21NO/c1-10(2)12-7-5-11(6-8-12)4-3-9-13/h3-4,10-11,13H,5-9H2,1-2H3/b4-3-
InChIKeyMHLFLAUYNYDHCR-ARJAWSKDSA-N
MW183.29 g/mol
LogP1.66
Rot. Bonds3

About (Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol

(Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol (PubChem CID 117265989) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is (Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol
PubChem CID117265989
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name(Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol
SMILESCC(C)N1CCC(/C=C\CO)CC1
InChIInChI=1S/C11H21NO/c1-10(2)12-7-5-11(6-8-12)4-3-9-13/h3-4,10-11,13H,5-9H2,1-2H3/b4-3-
InChIKeyMHLFLAUYNYDHCR-ARJAWSKDSA-N
XLogP1.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methyl (Z)-4-(1-propan-2-ylpiperidin-4-yl)but-3-enoate
CID 117267386
4-[(Z)-3-isocyanatoprop-1-enyl]-1-propan-2-ylpiperidine
CID 117267346
(E)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-enoic acid
CID 23062630
(Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-enoic acid
CID 117266122
(Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-enal
CID 117266045
3-cyclobutylprop-2-en-1-ol
CID 54225571
ethyl (E)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-enoate
CID 23062586
2-(1-propan-2-ylpiperidin-4-yl)propane-1,3-diol
CID 117239485
1-(1-propan-2-ylpiperidin-4-yl)ethane-1,2-diol
CID 117238997
1-propan-2-yl-4-(1-propan-2-ylpiperidin-4-yl)piperidine
CID 59059970
methane;1-propan-2-ylpiperidin-4-ol
CID 158347030
(Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol
CID 117266004

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol?
The IUPAC name of (Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol (CID 117265989) is (Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol.
What is the SMILES notation for (Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol?
The canonical SMILES for (Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol is CC(C)N1CCC(/C=C\CO)CC1.
What is the InChIKey of (Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol?
The InChIKey is MHLFLAUYNYDHCR-ARJAWSKDSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(2)12-7-5-11(6-8-12)4-3-9-13/h3-4,10-11,13H,5-9H2,1-2H3/b4-3-.
What are the key properties of (Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol?
(Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol has a molecular weight of 183.29 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol is sourced from PubChem (CID 117265989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).