5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine

C14H10ClN3O — CID 4800452

IUPAC5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine
SMILESClc1ccc(-c2nnc(Nc3ccccc3)o2)cc1
InChIInChI=1S/C14H10ClN3O/c15-11-8-6-10(7-9-11)13-17-18-14(19-13)16-12-4-2-1-3-5-12/h1-9H,(H,16,18)
InChIKeyQJDIBFOEXQTPSN-UHFFFAOYSA-N
MW271.71 g/mol
LogP4.13
Rot. Bonds3

About 5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine

5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine (PubChem CID 4800452) has the molecular formula C14H10ClN3O and a molecular weight of 271.71 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine
PubChem CID4800452
Molecular FormulaC14H10ClN3O
Molecular Weight271.71 g/mol
Exact Mass271.05
IUPAC Name5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine
SMILESClc1ccc(-c2nnc(Nc3ccccc3)o2)cc1
InChIInChI=1S/C14H10ClN3O/c15-11-8-6-10(7-9-11)13-17-18-14(19-13)16-12-4-2-1-3-5-12/h1-9H,(H,16,18)
InChIKeyQJDIBFOEXQTPSN-UHFFFAOYSA-N
XLogP4.13
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.71
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,5-diphenyl-1,3,4-oxadiazol-2-amine
CID 12616884
5-(4-methylphenyl)-N-phenyl-1,3,4-oxadiazol-2-amine
CID 1547963
4-chloro-N-(5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl)benzamide
CID 4128171
5-naphthalen-1-yl-N-phenyl-1,3,4-oxadiazol-2-amine
CID 2815521
5-(4-(Trifluoromethyl)phenyl)-N-phenyl-1,3,4-oxadiazol-2-amine
CID 49857867
4-(5-(Phenylamino)-1,3,4-oxadiazol-2-yl)benzonitrile
CID 49858060
4-chloro-N-[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 691499
4-chloro-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
CID 805087
2-{[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
CID 2966728
5-[2-(2,6-Dichloro-3-methyl-phenylamino)-phenyl]-[1,3,4]oxadiazol-2-yl-cyanamide
CID 14951371
2-chloro-N-[4-[5-(3-piperidin-1-ylpropylamino)-1,3,4-oxadiazol-2-yl]phenyl]benzamide
CID 24785604
N-(3-chloro-4-methylphenyl)-5-(4-nitrophenyl)-1,3,4-oxadiazol-2-amine
CID 49857866

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine (CID 4800452) is 5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine is Clc1ccc(-c2nnc(Nc3ccccc3)o2)cc1.
What is the InChIKey of 5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine?
The InChIKey is QJDIBFOEXQTPSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3O/c15-11-8-6-10(7-9-11)13-17-18-14(19-13)16-12-4-2-1-3-5-12/h1-9H,(H,16,18).
What are the key properties of 5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine?
5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine has a molecular weight of 271.71 g/mol, XLogP of 4.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-phenyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 4800452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).