3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide

C15H22ClNO2 — CID 134123782

IUPAC3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide
SMILESCC(C)CNC(=O)c1cc(Cl)c(O)c(C(C)(C)C)c1
InChIInChI=1S/C15H22ClNO2/c1-9(2)8-17-14(19)10-6-11(15(3,4)5)13(18)12(16)7-10/h6-7,9,18H,8H2,1-5H3,(H,17,19)
InChIKeyFELWRHUBFKPSKE-UHFFFAOYSA-N
MW283.80 g/mol
LogP3.73
Rot. Bonds3

About 3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide

3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide (PubChem CID 134123782) has the molecular formula C15H22ClNO2 and a molecular weight of 283.80 g/mol. Its IUPAC name is 3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide
PubChem CID134123782
Molecular FormulaC15H22ClNO2
Molecular Weight283.80 g/mol
Exact Mass283.13
IUPAC Name3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide
SMILESCC(C)CNC(=O)c1cc(Cl)c(O)c(C(C)(C)C)c1
InChIInChI=1S/C15H22ClNO2/c1-9(2)8-17-14(19)10-6-11(15(3,4)5)13(18)12(16)7-10/h6-7,9,18H,8H2,1-5H3,(H,17,19)
InChIKeyFELWRHUBFKPSKE-UHFFFAOYSA-N
XLogP3.73
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-tert-butyl-5-chloro-N-(2,2-dimethylpropyl)-4-hydroxybenzamide
CID 134094274
3,5-dichloro-4-methoxy-N-(2-methylpropyl)benzamide
CID 51217200
3-tert-butyl-5-methyl-N-(2-methylpropyl)benzamide
CID 90164942
7-chloro-N-(2-methylpropyl)-1,3-benzodioxole-5-carboxamide
CID 39754944
4,5-dichloro-1-N,2-N-bis(2-methylpropyl)benzene-1,2-dicarboxamide
CID 23967386
2-amino-6-tert-butyl-N-(2-methylpropyl)pyridine-4-carboxamide
CID 113380941
3-amino-4-chloro-N-(2-methylpropyl)benzamide
CID 838194
4-chloro-3-fluoro-N-(2-methylpropyl)benzamide
CID 103875490
3-chloro-4-ethoxy-N-(2-methylpropyl)benzamide
CID 1250371
3-chloro-N-ethyl-4,5-dihydroxybenzamide
CID 144617791
5,6-dichloro-N-[2-(2-methylpropylamino)-2-oxoethyl]pyridine-3-carboxamide
CID 49167384
3,4-dimethyl-N-(2-methylpropyl)-5-(methylsulfamoyl)benzamide
CID 27539196

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide?
The IUPAC name of 3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide (CID 134123782) is 3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide?
The canonical SMILES for 3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide is CC(C)CNC(=O)c1cc(Cl)c(O)c(C(C)(C)C)c1.
What is the InChIKey of 3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide?
The InChIKey is FELWRHUBFKPSKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO2/c1-9(2)8-17-14(19)10-6-11(15(3,4)5)13(18)12(16)7-10/h6-7,9,18H,8H2,1-5H3,(H,17,19).
What are the key properties of 3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide?
3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide has a molecular weight of 283.80 g/mol, XLogP of 3.73, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-5-chloro-4-hydroxy-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 134123782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).