2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide

C14H10ClN3O3 — CID 106685977

IUPAC2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide
SMILESCc1ccc(-c2nnco2)cc1NC(=O)c1ccoc1Cl
InChIInChI=1S/C14H10ClN3O3/c1-8-2-3-9(14-18-16-7-21-14)6-11(8)17-13(19)10-4-5-20-12(10)15/h2-7H,1H3,(H,17,19)
InChIKeyRFOXKSQTAOLJLS-UHFFFAOYSA-N
MW303.71 g/mol
LogP3.54
Rot. Bonds3

About 2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide

2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide (PubChem CID 106685977) has the molecular formula C14H10ClN3O3 and a molecular weight of 303.71 g/mol. Its IUPAC name is 2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide
PubChem CID106685977
Molecular FormulaC14H10ClN3O3
Molecular Weight303.71 g/mol
Exact Mass303.04
IUPAC Name2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide
SMILESCc1ccc(-c2nnco2)cc1NC(=O)c1ccoc1Cl
InChIInChI=1S/C14H10ClN3O3/c1-8-2-3-9(14-18-16-7-21-14)6-11(8)17-13(19)10-4-5-20-12(10)15/h2-7H,1H3,(H,17,19)
InChIKeyRFOXKSQTAOLJLS-UHFFFAOYSA-N
XLogP3.54
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.71
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]-1,3,4-thiadiazole-2-carboxamide
CID 80618296
3-[2-methyl-5-(1,3,4-oxadiazol-2-yl)anilino]-3-oxopropanoic acid
CID 62230630
2-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 43706139
2,2,2-trifluoro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 63374700
3-chloro-2,2-dimethyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]propanamide
CID 63679608
4-bromo-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]-1H-pyrrole-2-carboxamide
CID 60954664
5-(difluoromethyl)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]-1H-pyrazole-3-carboxamide
CID 166323565
2-amino-3-methyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide
CID 43706124
4-(methylamino)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]butanamide
CID 60842599
2-(3-chlorophenyl)-4-methyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]-1,3-thiazole-5-carboxamide
CID 55731775
1-benzyl-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]pyrazole-4-carboxamide
CID 87045572
2-(4-tert-butylphenyl)-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]-2-oxoacetamide
CID 75417439

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide?
The IUPAC name of 2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide (CID 106685977) is 2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide is Cc1ccc(-c2nnco2)cc1NC(=O)c1ccoc1Cl.
What is the InChIKey of 2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide?
The InChIKey is RFOXKSQTAOLJLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3O3/c1-8-2-3-9(14-18-16-7-21-14)6-11(8)17-13(19)10-4-5-20-12(10)15/h2-7H,1H3,(H,17,19).
What are the key properties of 2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide?
2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide has a molecular weight of 303.71 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-methyl-5-(1,3,4-oxadiazol-2-yl)phenyl]furan-3-carboxamide is sourced from PubChem (CID 106685977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).