[2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol

C26H32N4O2 — CID 95834271

IUPAC[2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol
SMILESCCOc1ccc(CN2CCC(c3ccc(Nc4cccc(C)n4)cn3)CC2)cc1CO
InChIInChI=1S/C26H32N4O2/c1-3-32-25-10-7-20(15-22(25)18-31)17-30-13-11-21(12-14-30)24-9-8-23(16-27-24)29-26-6-4-5-19(2)28-26/h4-10,15-16,21,31H,3,11-14,17-18H2,1-2H3,(H,28,29)
InChIKeyMADSMBDCJVSGNK-UHFFFAOYSA-N
MW432.57 g/mol
LogP4.80
Rot. Bonds8

About [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol

[2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol (PubChem CID 95834271) has the molecular formula C26H32N4O2 and a molecular weight of 432.57 g/mol. Its IUPAC name is [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol.

Molecular Properties

Compound Name[2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol
PubChem CID95834271
Molecular FormulaC26H32N4O2
Molecular Weight432.57 g/mol
Exact Mass432.25
IUPAC Name[2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol
SMILESCCOc1ccc(CN2CCC(c3ccc(Nc4cccc(C)n4)cn3)CC2)cc1CO
InChIInChI=1S/C26H32N4O2/c1-3-32-25-10-7-20(15-22(25)18-31)17-30-13-11-21(12-14-30)24-9-8-23(16-27-24)29-26-6-4-5-19(2)28-26/h4-10,15-16,21,31H,3,11-14,17-18H2,1-2H3,(H,28,29)
InChIKeyMADSMBDCJVSGNK-UHFFFAOYSA-N
XLogP4.80
TPSA70.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.57
LogP ≤ 54.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol with MolForge

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Launch Full Analysis

Related Compounds

[5-[[(2S)-2-[5-[(4,6-dimethylpyrimidin-2-yl)amino]-2-pyridinyl]morpholin-4-yl]methyl]-2-ethoxyphenyl]methanol
CID 124990832
[2-ethoxy-5-[[(3S)-3-[6-methyl-4-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol
CID 95834986
[5-[[(2R)-2-[6-[(1,5-dimethylpyrazol-3-yl)amino]-2-pyridinyl]morpholin-4-yl]methyl]-2-ethoxyphenyl]methanol
CID 124988259
N-[6-[(3R)-1-[(1-ethyl-5-methylpyrazol-4-yl)methyl]piperidin-3-yl]-3-pyridinyl]-6-methylpyridin-2-amine
CID 95813639
N,N-diethyl-2-[(3S)-3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetamide
CID 95813548
1-[1-[[4-ethoxy-3-(hydroxymethyl)phenyl]methyl]piperidin-4-yl]ethane-1,2-diol
CID 137339902
1,3-dimethyl-5-[[4-[6-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]benzimidazol-2-one
CID 110093965
2-[1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-4-yl]-6-methyl-N-(6-methyl-2-pyridinyl)pyridin-4-amine
CID 110093148
N-[6-[4-[(6-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine
CID 127249198
1-[2-[3-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]acetyl]piperidine-4-carboxamide
CID 110252308
[2-ethoxy-5-[[(2S)-2-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]phenyl]methanol
CID 124981234
[2-ethoxy-5-[[(2S)-2-[6-methyl-4-[(4-methyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]pyrrolidin-1-yl]methyl]phenyl]methanol
CID 95832823

Frequently Asked Questions

What is the IUPAC name of [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol?
The IUPAC name of [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol (CID 95834271) is [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol.
What is the SMILES notation for [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol?
The canonical SMILES for [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol is CCOc1ccc(CN2CCC(c3ccc(Nc4cccc(C)n4)cn3)CC2)cc1CO.
What is the InChIKey of [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol?
The InChIKey is MADSMBDCJVSGNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N4O2/c1-3-32-25-10-7-20(15-22(25)18-31)17-30-13-11-21(12-14-30)24-9-8-23(16-27-24)29-26-6-4-5-19(2)28-26/h4-10,15-16,21,31H,3,11-14,17-18H2,1-2H3,(H,28,29).
What are the key properties of [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol?
[2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol has a molecular weight of 432.57 g/mol, XLogP of 4.80, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethoxy-5-[[4-[5-[(6-methyl-2-pyridinyl)amino]-2-pyridinyl]piperidin-1-yl]methyl]phenyl]methanol is sourced from PubChem (CID 95834271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).