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

C10H10ClN3O — CID 1487943

IUPAC5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine
SMILESCN(C)c1nnc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C10H10ClN3O/c1-14(2)10-13-12-9(15-10)7-3-5-8(11)6-4-7/h3-6H,1-2H3
InChIKeyMYGKAVHQHCUMIZ-UHFFFAOYSA-N
MW223.66 g/mol
LogP2.46
Rot. Bonds2

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

5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine (PubChem CID 1487943) has the molecular formula C10H10ClN3O and a molecular weight of 223.66 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine
PubChem CID1487943
Molecular FormulaC10H10ClN3O
Molecular Weight223.66 g/mol
Exact Mass223.05
IUPAC Name5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine
SMILESCN(C)c1nnc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C10H10ClN3O/c1-14(2)10-13-12-9(15-10)7-3-5-8(11)6-4-7/h3-6H,1-2H3
InChIKeyMYGKAVHQHCUMIZ-UHFFFAOYSA-N
XLogP2.46
TPSA42.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.66
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-bromo-5-(4-chlorophenyl)-1,3,4-oxadiazole
CID 70874023
2-chloro-N-[4-[5-(dimethylamino)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluoroacetamide
CID 166430932
5-(4-chlorophenyl)-N,N-dimethyl-1,3-oxazol-2-amine
CID 13332314
2-(4-chlorophenyl)-5-(4-ethoxyphenyl)-1,3,4-oxadiazole
CID 866005
2-(4-chlorophenyl)-5-[4-(trifluoromethyl)phenyl]-1,3,4-oxadiazole
CID 850624
2-(2-chloroethyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole
CID 39347323
2-(chloromethylsulfanyl)-5-(4-chlorophenyl)-1,3,4-oxadiazole
CID 54132706
2-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]propanoic acid
CID 62637417
N-[4-[5-(dimethylamino)-1,3,4-oxadiazol-2-yl]phenyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 75390628
2-(4-chlorophenyl)-5-(3-methoxyphenyl)-1,3,4-oxadiazole
CID 687081
methyl 3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-methylamino]propanoate
CID 62013028
cis-(1S,2R)-2-cyclopropyl-N-[4-[5-(dimethylamino)-1,3,4-oxadiazol-2-yl]phenyl]cyclopropane-1-carboxamide
CID 97248853

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine (CID 1487943) is 5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine is CN(C)c1nnc(-c2ccc(Cl)cc2)o1.
What is the InChIKey of 5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine?
The InChIKey is MYGKAVHQHCUMIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O/c1-14(2)10-13-12-9(15-10)7-3-5-8(11)6-4-7/h3-6H,1-2H3.
What are the key properties of 5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine?
5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine has a molecular weight of 223.66 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N,N-dimethyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 1487943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).