[1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol

C15H24N2O2 — CID 61048674

IUPAC[1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol
SMILESCCN1CCC(CO)(Nc2cccc(OC)c2)CC1
InChIInChI=1S/C15H24N2O2/c1-3-17-9-7-15(12-18,8-10-17)16-13-5-4-6-14(11-13)19-2/h4-6,11,16,18H,3,7-10,12H2,1-2H3
InChIKeyIMCYQKKJAAZAOJ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.95
Rot. Bonds5

About [1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol

[1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol (PubChem CID 61048674) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is [1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol
PubChem CID61048674
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name[1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol
SMILESCCN1CCC(CO)(Nc2cccc(OC)c2)CC1
InChIInChI=1S/C15H24N2O2/c1-3-17-9-7-15(12-18,8-10-17)16-13-5-4-6-14(11-13)19-2/h4-6,11,16,18H,3,7-10,12H2,1-2H3
InChIKeyIMCYQKKJAAZAOJ-UHFFFAOYSA-N
XLogP1.95
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-ethyl-4-(3-methoxyanilino)piperidine-4-carboxylate
CID 60993286
4-(aminomethyl)-N-(3-methoxyphenyl)-1-propylpiperidin-4-amine
CID 65377742
1-[1-(hydroxymethyl)cyclopentyl]-3-(3-methoxyphenyl)urea
CID 62520319
[1-(3-methoxyanilino)-3-(2-methylpropyl)cyclohexyl]methanol
CID 107430208
1-[1-(hydroxymethyl)cyclohexyl]-3-(3-methoxyphenyl)urea
CID 62521313
4-(aminomethyl)-N-(3-methoxyphenyl)-1-propan-2-ylazepan-4-amine
CID 65378995
[4-(3-methylanilino)-1-propylazepan-4-yl]methanol
CID 65076521
5-(4-ethylpiperazin-1-yl)-N-(3-methoxyphenyl)-1,2,4-triazin-3-amine
CID 112946238
3-(4-ethylpiperazine-1-carbonyl)-N-(3-methoxyphenyl)benzamide
CID 109053712
[4-fluoro-1-(3-methoxyanilino)-2,3-dihydroinden-1-yl]methanol
CID 83058682
ethyl 3-(3-methoxyanilino)thiolane-3-carboxylate
CID 54890596
4-(4-ethylpiperazine-1-carbonyl)-N-(3-methoxyphenyl)cyclohexane-1-carboxamide
CID 109147563

Frequently Asked Questions

What is the IUPAC name of [1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol?
The IUPAC name of [1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol (CID 61048674) is [1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol.
What is the SMILES notation for [1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol?
The canonical SMILES for [1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol is CCN1CCC(CO)(Nc2cccc(OC)c2)CC1.
What is the InChIKey of [1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol?
The InChIKey is IMCYQKKJAAZAOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-17-9-7-15(12-18,8-10-17)16-13-5-4-6-14(11-13)19-2/h4-6,11,16,18H,3,7-10,12H2,1-2H3.
What are the key properties of [1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol?
[1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol has a molecular weight of 264.37 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol is sourced from PubChem (CID 61048674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).