2-methyl-5-phenoxybenzamide;hydrochloride

C14H14ClNO2 — CID 174534962

IUPAC2-methyl-5-phenoxybenzamide;hydrochloride
SMILESCc1ccc(Oc2ccccc2)cc1C(N)=O.Cl
InChIInChI=1S/C14H13NO2.ClH/c1-10-7-8-12(9-13(10)14(15)16)17-11-5-3-2-4-6-11;/h2-9H,1H3,(H2,15,16);1H
InChIKeyAZXTVHTZNBBPAM-UHFFFAOYSA-N
MW263.72 g/mol
LogP3.31
Rot. Bonds3

About 2-methyl-5-phenoxybenzamide;hydrochloride

2-methyl-5-phenoxybenzamide;hydrochloride (PubChem CID 174534962) has the molecular formula C14H14ClNO2 and a molecular weight of 263.72 g/mol. Its IUPAC name is 2-methyl-5-phenoxybenzamide;hydrochloride.

Molecular Properties

Compound Name2-methyl-5-phenoxybenzamide;hydrochloride
PubChem CID174534962
Molecular FormulaC14H14ClNO2
Molecular Weight263.72 g/mol
Exact Mass263.07
IUPAC Name2-methyl-5-phenoxybenzamide;hydrochloride
SMILESCc1ccc(Oc2ccccc2)cc1C(N)=O.Cl
InChIInChI=1S/C14H13NO2.ClH/c1-10-7-8-12(9-13(10)14(15)16)17-11-5-3-2-4-6-11;/h2-9H,1H3,(H2,15,16);1H
InChIKeyAZXTVHTZNBBPAM-UHFFFAOYSA-N
XLogP3.31
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.72
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-5-phenoxybenzamide
CID 135275179
3,5-dichloroaniline;2-methyl-4-phenoxybenzamide
CID 174930679
2-(N,2-dimethyl-5-phenoxyanilino)-2-phenylacetamide
CID 57189042
(2-carbamoyl-4-phenoxyphenyl) 2-[amino(hydroxy)amino]propanoate
CID 57218645
2-methylbenzamide;molecular hydrogen
CID 177161283
ethyl 2-(hydroxyamino)-5-phenoxybenzoate
CID 90258346
(2,6-dimethylphenyl)-(5-phenoxy-2-phosphanylphenyl)methanone
CID 174396027
5-(4-tert-butylphenoxy)-2-carbamoylbenzoic acid
CID 168918436
2-[(3-chloropyrazin-2-yl)methyl]-5-phenoxybenzamide
CID 173127851
2-methyl-4-phenoxyphenol
CID 23089676
2-methylbenzamide;phenol
CID 160508327
4-(2-methyl-4-phenoxyphenyl)-4-oxobutanoic acid
CID 82051081

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-phenoxybenzamide;hydrochloride?
The IUPAC name of 2-methyl-5-phenoxybenzamide;hydrochloride (CID 174534962) is 2-methyl-5-phenoxybenzamide;hydrochloride.
What is the SMILES notation for 2-methyl-5-phenoxybenzamide;hydrochloride?
The canonical SMILES for 2-methyl-5-phenoxybenzamide;hydrochloride is Cc1ccc(Oc2ccccc2)cc1C(N)=O.Cl.
What is the InChIKey of 2-methyl-5-phenoxybenzamide;hydrochloride?
The InChIKey is AZXTVHTZNBBPAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2.ClH/c1-10-7-8-12(9-13(10)14(15)16)17-11-5-3-2-4-6-11;/h2-9H,1H3,(H2,15,16);1H.
What are the key properties of 2-methyl-5-phenoxybenzamide;hydrochloride?
2-methyl-5-phenoxybenzamide;hydrochloride has a molecular weight of 263.72 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-phenoxybenzamide;hydrochloride is sourced from PubChem (CID 174534962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).