2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol

C10H19NO — CID 117266691

IUPAC2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol
SMILESC=C(CO)CC1CCCCN1C
InChIInChI=1S/C10H19NO/c1-9(8-12)7-10-5-3-4-6-11(10)2/h10,12H,1,3-8H2,2H3
InChIKeyWKPMMBYGUJBGNH-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.41
Rot. Bonds3

About 2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol

2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol (PubChem CID 117266691) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol.

Molecular Properties

Compound Name2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol
PubChem CID117266691
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol
SMILESC=C(CO)CC1CCCCN1C
InChIInChI=1S/C10H19NO/c1-9(8-12)7-10-5-3-4-6-11(10)2/h10,12H,1,3-8H2,2H3
InChIKeyWKPMMBYGUJBGNH-UHFFFAOYSA-N
XLogP1.41
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 ≤ 51.41
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

2-[1-(2-Methylidenebutyl)piperidin-2-yl]ethanol
CID 66038303
(2R)-4-methyl-1-[(2S)-1-methylpiperidin-2-yl]pent-4-en-2-ol
CID 102286866
1-[1-(2-Methylidenebutyl)piperidin-2-yl]propan-2-ol
CID 114338085
2-[1-(3-Methylbut-3-enyl)piperidin-2-yl]ethanol
CID 114448957
1-[1-(3-Methylbut-3-enyl)piperidin-2-yl]propan-2-ol
CID 114478094
2-[(1-Propan-2-ylpiperidin-4-yl)methyl]prop-2-en-1-ol
CID 117266660
2-(1-Methylpiperidin-3-yl)prop-2-en-1-ol
CID 117266665
2-(1-Ethylpiperidin-3-yl)prop-2-en-1-ol
CID 117266666
2-(1-Propan-2-ylpiperidin-3-yl)prop-2-en-1-ol
CID 117266667
2-(1-Methylpiperidin-2-yl)prop-2-en-1-ol
CID 117266678
2-(1-Ethylpiperidin-2-yl)prop-2-en-1-ol
CID 117266679
2-(1-Propan-2-ylpiperidin-2-yl)prop-2-en-1-ol
CID 117266680

Frequently Asked Questions

What is the IUPAC name of 2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol?
The IUPAC name of 2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol (CID 117266691) is 2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol.
What is the SMILES notation for 2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol?
The canonical SMILES for 2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol is C=C(CO)CC1CCCCN1C.
What is the InChIKey of 2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol?
The InChIKey is WKPMMBYGUJBGNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-9(8-12)7-10-5-3-4-6-11(10)2/h10,12H,1,3-8H2,2H3.
What are the key properties of 2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol?
2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol has a molecular weight of 169.27 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methylpiperidin-2-yl)methyl]prop-2-en-1-ol is sourced from PubChem (CID 117266691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).