N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide

C10H9F2N5O — CID 110500527

IUPACN-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide
SMILESCn1nnnc1CC(=O)Nc1cc(F)ccc1F
InChIInChI=1S/C10H9F2N5O/c1-17-9(14-15-16-17)5-10(18)13-8-4-6(11)2-3-7(8)12/h2-4H,5H2,1H3,(H,13,18)
InChIKeyFAUFZUOUZPOMFJ-UHFFFAOYSA-N
MW253.21 g/mol
LogP0.67
Rot. Bonds3

About N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide

N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide (PubChem CID 110500527) has the molecular formula C10H9F2N5O and a molecular weight of 253.21 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide
PubChem CID110500527
Molecular FormulaC10H9F2N5O
Molecular Weight253.21 g/mol
Exact Mass253.08
IUPAC NameN-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide
SMILESCn1nnnc1CC(=O)Nc1cc(F)ccc1F
InChIInChI=1S/C10H9F2N5O/c1-17-9(14-15-16-17)5-10(18)13-8-4-6(11)2-3-7(8)12/h2-4H,5H2,1H3,(H,13,18)
InChIKeyFAUFZUOUZPOMFJ-UHFFFAOYSA-N
XLogP0.67
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.21
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-chloro-2-methylphenyl)-2-(1-methyltetrazol-5-yl)acetamide
CID 110500376
N-(2,5-dimethylphenyl)-2-(1-methyltetrazol-5-yl)acetamide
CID 110500390
N-(2,5-difluorophenyl)-2-(2H-tetrazol-5-yl)acetamide
CID 110499510
N-(4-hydroxyphenyl)-2-(1-methyltetrazol-5-yl)acetamide
CID 110500369
N-(3-acetamidophenyl)-2-(1-methyltetrazol-5-yl)acetamide
CID 110500481
2-(1-methyltetrazol-5-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 110500529
N-[2-(2,5-difluoroanilino)-2-oxoethyl]-N,1-dimethylbenzotriazole-5-carboxamide
CID 46296368
2-[5-[2-(2,5-difluoroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-N-(2-fluorophenyl)acetamide
CID 17019510
N-(2,5-difluorophenyl)-1-methylbenzotriazole-5-carboxamide
CID 53051524
N-(2,5-difluorophenyl)-2-[1-(2,4,6-trimethylphenyl)tetrazol-5-yl]sulfanylacetamide
CID 11552839
N-(2,5-difluorophenyl)-3-hydroxypropanamide
CID 68503422
[2-(2,5-difluoroanilino)-2-oxoethyl]-[(2,4-dimethylphenyl)methyl]-methylazanium
CID 9045612

Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide?
The IUPAC name of N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide (CID 110500527) is N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide?
The canonical SMILES for N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide is Cn1nnnc1CC(=O)Nc1cc(F)ccc1F.
What is the InChIKey of N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide?
The InChIKey is FAUFZUOUZPOMFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N5O/c1-17-9(14-15-16-17)5-10(18)13-8-4-6(11)2-3-7(8)12/h2-4H,5H2,1H3,(H,13,18).
What are the key properties of N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide?
N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide has a molecular weight of 253.21 g/mol, XLogP of 0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)-2-(1-methyltetrazol-5-yl)acetamide is sourced from PubChem (CID 110500527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).