(Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol

C10H19NO — CID 117266004

IUPAC(Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol
SMILESCCN1CCCC(/C=C\CO)C1
InChIInChI=1S/C10H19NO/c1-2-11-7-3-5-10(9-11)6-4-8-12/h4,6,10,12H,2-3,5,7-9H2,1H3/b6-4-
InChIKeyVMXDQESMEJTAGS-XQRVVYSFSA-N
MW169.27 g/mol
LogP1.27
Rot. Bonds3

About (Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol

(Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol (PubChem CID 117266004) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol
PubChem CID117266004
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol
SMILESCCN1CCCC(/C=C\CO)C1
InChIInChI=1S/C10H19NO/c1-2-11-7-3-5-10(9-11)6-4-8-12/h4,6,10,12H,2-3,5,7-9H2,1H3/b6-4-
InChIKeyVMXDQESMEJTAGS-XQRVVYSFSA-N
XLogP1.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.27
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

(Z)-4-(1-ethylpiperidin-3-yl)but-3-en-1-ol
CID 117267523
[(3S)-1-ethylpiperidin-3-yl]methanol
CID 26722496
(Z)-4-(1-ethylpiperidin-4-yl)but-2-en-1-ol
CID 117266002
(3R)-1-ethyl-N,N-dimethylpiperidin-3-amine
CID 95912118
ethane;1-ethyl-3-methylpiperidine
CID 91361629
(Z)-3-(1-propan-2-ylpiperidin-4-yl)prop-2-en-1-ol
CID 117265989
1-ethylpyrrolidine-3-carbaldehyde
CID 84647972
(3R)-1-ethylpyrrolidine-3-carbaldehyde
CID 97182013
1-(1-ethylpiperidin-3-yl)cyclopropan-1-ol
CID 115073844
[(3R)-1-ethylpiperidin-3-yl]methanamine
CID 7200431
N-ethyl-2-(3-formylpiperidin-1-yl)-N-methylacetamide
CID 62655686
(Z)-4-(1-methylpiperidin-3-yl)but-3-enoic acid
CID 117267539

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol?
The IUPAC name of (Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol (CID 117266004) is (Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol.
What is the SMILES notation for (Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol?
The canonical SMILES for (Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol is CCN1CCCC(/C=C\CO)C1.
What is the InChIKey of (Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol?
The InChIKey is VMXDQESMEJTAGS-XQRVVYSFSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-11-7-3-5-10(9-11)6-4-8-12/h4,6,10,12H,2-3,5,7-9H2,1H3/b6-4-.
What are the key properties of (Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol?
(Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol has a molecular weight of 169.27 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(1-ethylpiperidin-3-yl)prop-2-en-1-ol is sourced from PubChem (CID 117266004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).