4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol

C10H20N2O — CID 82281000

IUPAC4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol
SMILESC=CCN1CCC(O)(CNC)CC1
InChIInChI=1S/C10H20N2O/c1-3-6-12-7-4-10(13,5-8-12)9-11-2/h3,11,13H,1,4-9H2,2H3
InChIKeyDDVFVHCQFFGOHH-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.22
Rot. Bonds4

About 4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol

4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol (PubChem CID 82281000) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol.

Molecular Properties

Compound Name4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol
PubChem CID82281000
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol
SMILESC=CCN1CCC(O)(CNC)CC1
InChIInChI=1S/C10H20N2O/c1-3-6-12-7-4-10(13,5-8-12)9-11-2/h3,11,13H,1,4-9H2,2H3
InChIKeyDDVFVHCQFFGOHH-UHFFFAOYSA-N
XLogP0.22
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.22
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

1-Methyl-4-((methylamino)methyl)piperidin-4-ol
CID 14153814
4-((Dimethylamino)methyl)piperidin-4-ol
CID 14578470
1-Ethyl-4-(methylaminomethyl)piperidin-4-ol
CID 20137971
4-Ethylaminomethyl-4-hydroxy-1-methylpiperidine
CID 22097496
4-[(Diethylamino)methyl]piperidin-4-ol
CID 28279659
4-[[Ethyl(methyl)amino]methyl]piperidin-4-ol
CID 62221491
4-[[Ethyl(propyl)amino]methyl]piperidin-4-ol
CID 62221852
3-Ethyl-1,5-bis(prop-2-enylamino)pentan-3-ol
CID 88214629
3-(Aminomethyl)-1,5-bis(prop-2-enylamino)pentan-3-ol
CID 88441360
1-Methyl-4-(methylaminomethyl)piperidin-4-ol;prop-1-ene
CID 144950491
chloromethane;1-[(E)-2-ethenylbut-2-enyl]-4-(methylaminomethyl)piperidin-4-ol
CID 145044371
1-(2-Methylidenebut-3-enyl)-4-[2-(propan-2-ylamino)ethyl]piperidin-4-ol
CID 156093037

Frequently Asked Questions

What is the IUPAC name of 4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol?
The IUPAC name of 4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol (CID 82281000) is 4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol.
What is the SMILES notation for 4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol?
The canonical SMILES for 4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol is C=CCN1CCC(O)(CNC)CC1.
What is the InChIKey of 4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol?
The InChIKey is DDVFVHCQFFGOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-3-6-12-7-4-10(13,5-8-12)9-11-2/h3,11,13H,1,4-9H2,2H3.
What are the key properties of 4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol?
4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol has a molecular weight of 184.28 g/mol, XLogP of 0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylaminomethyl)-1-prop-2-enylpiperidin-4-ol is sourced from PubChem (CID 82281000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).