N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide

C12H17NO2 — CID 16426

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IUPACN-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(OC(C)(C)C)cc1
InChIInChI=1S/C12H17NO2/c1-9(14)13-10-5-7-11(8-6-10)15-12(2,3)4/h5-8H,1-4H3,(H,13,14)
InChIKeyQTNZYVAMNRDUAD-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.82
Rot. Bonds2

About N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide

N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide (PubChem CID 16426) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide
PubChem CID16426
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC NameN-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(OC(C)(C)C)cc1
InChIInChI=1S/C12H17NO2/c1-9(14)13-10-5-7-11(8-6-10)15-12(2,3)4/h5-8H,1-4H3,(H,13,14)
InChIKeyQTNZYVAMNRDUAD-UHFFFAOYSA-N
XLogP2.82
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Phenacetin
CID 4754
Practolol
CID 4883
Propacetamol
CID 68865
Bucetin
CID 14130
N-(4-Methoxyphenyl)Acetamide
CID 5827
Dulcin
CID 9013
4-Hexyloxyaniline
CID 38360
4,4'-Dimethoxydiphenylamine
CID 7571
Diacetamate
CID 17499
N-(4-Ethoxyphenyl)-3-oxobutanamide
CID 61053
Acetamide, N-(2-methoxyphenyl)-
CID 7135
4-Isopropoxydiphenylamine
CID 7574

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide?
The IUPAC name of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide (CID 16426) is N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide is CC(=O)Nc1ccc(OC(C)(C)C)cc1.
What is the InChIKey of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide?
The InChIKey is QTNZYVAMNRDUAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-9(14)13-10-5-7-11(8-6-10)15-12(2,3)4/h5-8H,1-4H3,(H,13,14).
What are the key properties of N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide?
N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide has a molecular weight of 207.27 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide is sourced from PubChem (CID 16426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).