[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol

C16H21N3O2 — CID 104934517

IUPAC[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol
SMILESOCC1CCCCC1NCc1nnc(-c2ccccc2)o1
InChIInChI=1S/C16H21N3O2/c20-11-13-8-4-5-9-14(13)17-10-15-18-19-16(21-15)12-6-2-1-3-7-12/h1-3,6-7,13-14,17,20H,4-5,8-11H2
InChIKeyOACSLMJTOMDDKY-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.38
Rot. Bonds5

About [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol

[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol (PubChem CID 104934517) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol
PubChem CID104934517
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol
SMILESOCC1CCCCC1NCc1nnc(-c2ccccc2)o1
InChIInChI=1S/C16H21N3O2/c20-11-13-8-4-5-9-14(13)17-10-15-18-19-16(21-15)12-6-2-1-3-7-12/h1-3,6-7,13-14,17,20H,4-5,8-11H2
InChIKeyOACSLMJTOMDDKY-UHFFFAOYSA-N
XLogP2.38
TPSA71.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol 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

[2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methylamino]cycloheptyl]methanol
CID 75457226
[(1R,2R)-2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methylamino]cycloheptyl]methanol
CID 97307380
[2-[(5-phenyl-1H-pyrazol-4-yl)methylamino]cyclohexyl]methanol
CID 106359839
[2-[(4-phenyl-1,3-thiazol-2-yl)methylamino]cyclohexyl]methanol
CID 103684804
2,2,3,3-tetramethyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]cyclopropan-1-amine
CID 79359225
2-(oxan-2-yl)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]acetamide
CID 110606908
trans-(1S,2S)-2-benzyl-N-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentan-1-amine
CID 99796112
[2-[[5-(hydroxymethyl)furan-2-yl]methylamino]cyclohexyl]methanol
CID 103699678
N-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentanamine
CID 2513524
(5-phenyl-1,3,4-oxadiazol-2-yl)methyl 2-cyclopentylacetate
CID 78760189
3-methyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pentan-3-amine
CID 103746773
[2-[[5-(hydroxymethyl)furan-2-yl]methylamino]cyclopentyl]methanol
CID 115655020

Frequently Asked Questions

What is the IUPAC name of [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol?
The IUPAC name of [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol (CID 104934517) is [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol.
What is the SMILES notation for [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol?
The canonical SMILES for [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol is OCC1CCCCC1NCc1nnc(-c2ccccc2)o1.
What is the InChIKey of [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol?
The InChIKey is OACSLMJTOMDDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c20-11-13-8-4-5-9-14(13)17-10-15-18-19-16(21-15)12-6-2-1-3-7-12/h1-3,6-7,13-14,17,20H,4-5,8-11H2.
What are the key properties of [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol?
[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol has a molecular weight of 287.36 g/mol, XLogP of 2.38, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylamino]cyclohexyl]methanol is sourced from PubChem (CID 104934517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).