1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol

C15H22N2O — CID 75416206

IUPAC1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol
SMILESC=C(C)CNc1ccccc1N1CCC(O)CC1
InChIInChI=1S/C15H22N2O/c1-12(2)11-16-14-5-3-4-6-15(14)17-9-7-13(18)8-10-17/h3-6,13,16,18H,1,7-11H2,2H3
InChIKeyKUAJGXDOFAQUEP-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.64
Rot. Bonds4

About 1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol

1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol (PubChem CID 75416206) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol
PubChem CID75416206
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol
SMILESC=C(C)CNc1ccccc1N1CCC(O)CC1
InChIInChI=1S/C15H22N2O/c1-12(2)11-16-14-5-3-4-6-15(14)17-9-7-13(18)8-10-17/h3-6,13,16,18H,1,7-11H2,2H3
InChIKeyKUAJGXDOFAQUEP-UHFFFAOYSA-N
XLogP2.64
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.64
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

N-[(1S)-1-cyclopropylethyl]-2-[2-(4-hydroxypiperidin-1-yl)anilino]acetamide
CID 94631561
N-(2-chloro-4-methylphenyl)-2-[2-(4-hydroxypiperidin-1-yl)anilino]acetamide
CID 52704908
2-[2-(4-hydroxypiperidin-1-yl)anilino]-1-[(3S)-3-methylpiperidin-1-yl]ethanone
CID 94631571
N-(2,5-dimethylphenyl)-2-[2-(4-hydroxypiperidin-1-yl)anilino]acetamide
CID 47064281
2-[2-(4-hydroxypiperidin-1-yl)anilino]-N-naphthalen-1-ylacetamide
CID 51121729
1-[2-[(2,6-difluorophenyl)methylamino]phenyl]piperidin-4-ol
CID 110018792
2-[2-(4-hydroxypiperidin-1-yl)anilino]-1-(2-methylmorpholin-4-yl)ethanone
CID 102554288
1-[2-[(5-chloro-1-methylimidazol-2-yl)methylamino]phenyl]piperidin-4-ol
CID 111778083
1-[2-[(4-methyl-1,3-thiazol-5-yl)methylamino]phenyl]piperidin-4-ol
CID 99824551
1-[2-[(2-ethylpyrazol-3-yl)methylamino]phenyl]piperidin-4-ol
CID 91650833
N-(5-chloro-2,4-dimethoxyphenyl)-2-[2-(4-hydroxypiperidin-1-yl)anilino]acetamide
CID 55917555
N-(3-chloro-4-methoxyphenyl)-2-[2-(4-hydroxypiperidin-1-yl)anilino]acetamide
CID 60539290

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol?
The IUPAC name of 1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol (CID 75416206) is 1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol.
What is the SMILES notation for 1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol?
The canonical SMILES for 1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol is C=C(C)CNc1ccccc1N1CCC(O)CC1.
What is the InChIKey of 1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol?
The InChIKey is KUAJGXDOFAQUEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12(2)11-16-14-5-3-4-6-15(14)17-9-7-13(18)8-10-17/h3-6,13,16,18H,1,7-11H2,2H3.
What are the key properties of 1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol?
1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol has a molecular weight of 246.35 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methylprop-2-enylamino)phenyl]piperidin-4-ol is sourced from PubChem (CID 75416206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).