1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol

C26H27N3O3 — CID 86889645

IUPAC1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol
SMILESOC(COc1cccc2ccccc12)CN1CCC(c2nc(-c3ccccc3)no2)CC1
InChIInChI=1S/C26H27N3O3/c30-22(18-31-24-12-6-10-19-7-4-5-11-23(19)24)17-29-15-13-21(14-16-29)26-27-25(28-32-26)20-8-2-1-3-9-20/h1-12,21-22,30H,13-18H2
InChIKeyAWVHICMFOVCLBN-UHFFFAOYSA-N
MW429.52 g/mol
LogP4.51
Rot. Bonds7

About 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol

1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol (PubChem CID 86889645) has the molecular formula C26H27N3O3 and a molecular weight of 429.52 g/mol. Its IUPAC name is 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol
PubChem CID86889645
Molecular FormulaC26H27N3O3
Molecular Weight429.52 g/mol
Exact Mass429.21
IUPAC Name1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol
SMILESOC(COc1cccc2ccccc12)CN1CCC(c2nc(-c3ccccc3)no2)CC1
InChIInChI=1S/C26H27N3O3/c30-22(18-31-24-12-6-10-19-7-4-5-11-23(19)24)17-29-15-13-21(14-16-29)26-27-25(28-32-26)20-8-2-1-3-9-20/h1-12,21-22,30H,13-18H2
InChIKeyAWVHICMFOVCLBN-UHFFFAOYSA-N
XLogP4.51
TPSA71.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.52
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-1-naphthalen-1-yloxy-3-[(3S)-3-phenylpyrrolidin-1-yl]propan-2-ol
CID 100856123
1-naphthalen-1-yloxy-3-piperidin-1-ylpropan-2-ol;hydrochloride
CID 14556459
1-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperidin-3-ol
CID 18081673
4-[2-hydroxy-3-[4-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propyl]-3-phenyl-1,2,4-oxadiazol-5-one
CID 86903919
1-phenoxy-3-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]propan-2-ol
CID 4206507
(3,4-dimethoxyphenyl)-[1-(2-hydroxy-3-naphthalen-1-yloxypropyl)piperidin-4-yl]methanone
CID 67697221
5-[1-[(1-methylimidazol-2-yl)methyl]piperidin-4-yl]-3-phenyl-1,2,4-oxadiazole
CID 56896959
[2-(cyclopropylmethoxy)phenyl]-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
CID 86889075
1-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]-3-(4-methylpiperidin-1-yl)propan-2-ol
CID 84590494
1-[[2-(1-hydroxyethyl)-1-benzofuran-4-yl]oxy]-3-(4-naphthalen-2-ylpiperidin-1-yl)propan-2-ol
CID 22729129
1-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]-3-phenoxypropan-2-ol
CID 140972247
1-(2-hydroxy-3-naphthalen-1-yloxypropyl)-1,4-diazepan-5-one
CID 110882982

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol?
The IUPAC name of 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol (CID 86889645) is 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol.
What is the SMILES notation for 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol?
The canonical SMILES for 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol is OC(COc1cccc2ccccc12)CN1CCC(c2nc(-c3ccccc3)no2)CC1.
What is the InChIKey of 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol?
The InChIKey is AWVHICMFOVCLBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N3O3/c30-22(18-31-24-12-6-10-19-7-4-5-11-23(19)24)17-29-15-13-21(14-16-29)26-27-25(28-32-26)20-8-2-1-3-9-20/h1-12,21-22,30H,13-18H2.
What are the key properties of 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol?
1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol has a molecular weight of 429.52 g/mol, XLogP of 4.51, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yloxy-3-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]propan-2-ol is sourced from PubChem (CID 86889645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).