1-piperidin-2-ylethanol;prop-1-ene

C10H21NO — CID 155698615

IUPAC1-piperidin-2-ylethanol;prop-1-ene
SMILESC=CC.CC(O)C1CCCCN1
InChIInChI=1S/C7H15NO.C3H6/c1-6(9)7-4-2-3-5-8-7;1-3-2/h6-9H,2-5H2,1H3;3H,1H2,2H3
InChIKeyATJMPOZBQJEAHP-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.70
Rot. Bonds1

About 1-piperidin-2-ylethanol;prop-1-ene

1-piperidin-2-ylethanol;prop-1-ene (PubChem CID 155698615) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 1-piperidin-2-ylethanol;prop-1-ene.

Molecular Properties

Compound Name1-piperidin-2-ylethanol;prop-1-ene
PubChem CID155698615
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name1-piperidin-2-ylethanol;prop-1-ene
SMILESC=CC.CC(O)C1CCCCN1
InChIInChI=1S/C7H15NO.C3H6/c1-6(9)7-4-2-3-5-8-7;1-3-2/h6-9H,2-5H2,1H3;3H,1H2,2H3
InChIKeyATJMPOZBQJEAHP-UHFFFAOYSA-N
XLogP1.70
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(Piperidin-2-yl)propan-1-ol
CID 10314
(3S,6S)-6-Propyl-3-piperidinol
CID 120641
Conhydrine
CID 11744748
1-(Piperidin-2-yl)ethan-1-ol
CID 335682
1-[(2S)-piperidin-2-yl]ethan-1-ol
CID 166739396
Pseudo-conhydrine
CID 73805498
6-Propylpiperidin-3-ol
CID 4367461
1-[(2R)-piperidin-2-yl]ethan-1-ol
CID 177929475
1-Piperidin-1-ium-2-ylpropan-1-ol
CID 25200349
(1R)-1-[(2R)-piperidin-2-yl]propan-1-ol
CID 11040809
(alphaS,2R)-alpha-Ethyl-2-piperidinemethanol
CID 11309577
(3S,6R)-6-propylpiperidin-3-ol
CID 11744749

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-2-ylethanol;prop-1-ene?
The IUPAC name of 1-piperidin-2-ylethanol;prop-1-ene (CID 155698615) is 1-piperidin-2-ylethanol;prop-1-ene.
What is the SMILES notation for 1-piperidin-2-ylethanol;prop-1-ene?
The canonical SMILES for 1-piperidin-2-ylethanol;prop-1-ene is C=CC.CC(O)C1CCCCN1.
What is the InChIKey of 1-piperidin-2-ylethanol;prop-1-ene?
The InChIKey is ATJMPOZBQJEAHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.C3H6/c1-6(9)7-4-2-3-5-8-7;1-3-2/h6-9H,2-5H2,1H3;3H,1H2,2H3.
What are the key properties of 1-piperidin-2-ylethanol;prop-1-ene?
1-piperidin-2-ylethanol;prop-1-ene has a molecular weight of 171.28 g/mol, XLogP of 1.70, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-2-ylethanol;prop-1-ene is sourced from PubChem (CID 155698615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).