1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol

C15H24N2O — CID 82296733

IUPAC1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol
SMILESCc1ccc(C2(O)CCN(CCN)CC2)c(C)c1
InChIInChI=1S/C15H24N2O/c1-12-3-4-14(13(2)11-12)15(18)5-8-17(9-6-15)10-7-16/h3-4,11,18H,5-10,16H2,1-2H3
InChIKeyPFWCDFDCVHYYTH-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.55
Rot. Bonds3

About 1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol

1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol (PubChem CID 82296733) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol
PubChem CID82296733
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol
SMILESCc1ccc(C2(O)CCN(CCN)CC2)c(C)c1
InChIInChI=1S/C15H24N2O/c1-12-3-4-14(13(2)11-12)15(18)5-8-17(9-6-15)10-7-16/h3-4,11,18H,5-10,16H2,1-2H3
InChIKeyPFWCDFDCVHYYTH-UHFFFAOYSA-N
XLogP1.55
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,4-dimethylphenyl)-1-ethylpiperidin-4-ol
CID 62801498
1-(2-aminoethyl)-4-(2,3-dimethylphenyl)piperidin-4-ol
CID 82296734
1-(2-aminoethyl)-4-phenylpiperidin-4-ol
CID 15289503
4-(2-methoxy-5-methylphenyl)-1-propylpiperidin-4-ol
CID 55120385
3-(2,5-dimethylphenyl)-1-ethylpyrrolidin-3-ol
CID 165403438
1-ethyl-4-(2,4,5-trimethylphenyl)piperidin-4-ol
CID 64984824
1-ethyl-4-(2-fluoro-5-methylphenyl)azepan-4-ol
CID 65077601
1-(2,4-dimethylphenyl)-4-ethylcycloheptan-1-ol
CID 65085735
1-(2,4-dimethylphenyl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 63406861
1-[4-(2-aminoethyl)piperazin-1-yl]-2-(2,5-dimethylphenyl)ethanone
CID 62538822
3-(2,4-dimethylphenyl)-1,1-dioxothiolan-3-ol
CID 63162720
1-benzyl-3-(2,4-dimethylphenyl)pyrrolidin-3-amine
CID 130137268

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol?
The IUPAC name of 1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol (CID 82296733) is 1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol.
What is the SMILES notation for 1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol?
The canonical SMILES for 1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol is Cc1ccc(C2(O)CCN(CCN)CC2)c(C)c1.
What is the InChIKey of 1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol?
The InChIKey is PFWCDFDCVHYYTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-3-4-14(13(2)11-12)15(18)5-8-17(9-6-15)10-7-16/h3-4,11,18H,5-10,16H2,1-2H3.
What are the key properties of 1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol?
1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol has a molecular weight of 248.37 g/mol, XLogP of 1.55, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-4-(2,4-dimethylphenyl)piperidin-4-ol is sourced from PubChem (CID 82296733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).