1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol

C23H25N3O — CID 75391244

IUPAC1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol
SMILESOC1CCN(c2ncccc2NCc2cccc(-c3ccccc3)c2)CC1
InChIInChI=1S/C23H25N3O/c27-21-11-14-26(15-12-21)23-22(10-5-13-24-23)25-17-18-6-4-9-20(16-18)19-7-2-1-3-8-19/h1-10,13,16,21,25,27H,11-12,14-15,17H2
InChIKeyBUCMCJSHBBEAMP-UHFFFAOYSA-N
MW359.47 g/mol
LogP4.32
Rot. Bonds5

About 1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol

1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol (PubChem CID 75391244) has the molecular formula C23H25N3O and a molecular weight of 359.47 g/mol. Its IUPAC name is 1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol
PubChem CID75391244
Molecular FormulaC23H25N3O
Molecular Weight359.47 g/mol
Exact Mass359.20
IUPAC Name1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol
SMILESOC1CCN(c2ncccc2NCc2cccc(-c3ccccc3)c2)CC1
InChIInChI=1S/C23H25N3O/c27-21-11-14-26(15-12-21)23-22(10-5-13-24-23)25-17-18-6-4-9-20(16-18)19-7-2-1-3-8-19/h1-10,13,16,21,25,27H,11-12,14-15,17H2
InChIKeyBUCMCJSHBBEAMP-UHFFFAOYSA-N
XLogP4.32
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-(1H-pyrazol-4-ylmethylamino)-2-pyridinyl]piperidin-4-ol
CID 167886198
1-[3-(thieno[3,2-b]pyridin-6-ylmethylamino)-2-pyridinyl]piperidin-4-ol
CID 166197283
N-[(3-bromophenyl)methyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676391
1-[3-(fluoroamino)-2-pyridinyl]piperidin-4-ol
CID 89185599
1-[3-(2,1,3-benzothiadiazol-4-ylmethylamino)-2-pyridinyl]piperidin-4-ol
CID 167834826
4-[[(2-pyrrolidin-1-yl-3-pyridinyl)amino]methyl]benzene-1,2-diol
CID 43676426
2-phenyl-N-[(3-pyridin-2-ylphenyl)methyl]aniline
CID 140871795
2-bromo-4-[[(2-pyrrolidin-1-yl-3-pyridinyl)amino]methyl]phenol
CID 63045195
1-[2-fluoro-4-[(pyrimidin-2-ylamino)methyl]phenyl]piperidin-4-ol
CID 56796904
1-[3-[(3-pyridin-4-ylphenyl)methylamino]propyl]piperidin-4-ol
CID 111478246
3-[[[4-(4-hydroxypiperidin-1-yl)-6-phenylpyrimidin-2-yl]amino]methyl]benzamide
CID 68649585
1-[2-[[3-(hydroxymethyl)phenyl]methylamino]pyrimidin-4-yl]pyrrolidin-3-ol
CID 134710523

Frequently Asked Questions

What is the IUPAC name of 1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol?
The IUPAC name of 1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol (CID 75391244) is 1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol.
What is the SMILES notation for 1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol?
The canonical SMILES for 1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol is OC1CCN(c2ncccc2NCc2cccc(-c3ccccc3)c2)CC1.
What is the InChIKey of 1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol?
The InChIKey is BUCMCJSHBBEAMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O/c27-21-11-14-26(15-12-21)23-22(10-5-13-24-23)25-17-18-6-4-9-20(16-18)19-7-2-1-3-8-19/h1-10,13,16,21,25,27H,11-12,14-15,17H2.
What are the key properties of 1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol?
1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol has a molecular weight of 359.47 g/mol, XLogP of 4.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[(3-phenylphenyl)methylamino]-2-pyridinyl]piperidin-4-ol is sourced from PubChem (CID 75391244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).