N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide

C20H25NO3 — CID 17142483

IUPACN-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide
SMILESCC(C)COc1ccccc1NC(=O)c1cccc(OC(C)C)c1
InChIInChI=1S/C20H25NO3/c1-14(2)13-23-19-11-6-5-10-18(19)21-20(22)16-8-7-9-17(12-16)24-15(3)4/h5-12,14-15H,13H2,1-4H3,(H,21,22)
InChIKeyUUBHPSYBRYZXDF-UHFFFAOYSA-N
MW327.42 g/mol
LogP4.76
Rot. Bonds7

About N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide

N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide (PubChem CID 17142483) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide
PubChem CID17142483
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC NameN-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide
SMILESCC(C)COc1ccccc1NC(=O)c1cccc(OC(C)C)c1
InChIInChI=1S/C20H25NO3/c1-14(2)13-23-19-11-6-5-10-18(19)21-20(22)16-8-7-9-17(12-16)24-15(3)4/h5-12,14-15H,13H2,1-4H3,(H,21,22)
InChIKeyUUBHPSYBRYZXDF-UHFFFAOYSA-N
XLogP4.76
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-butoxy-N-[2-(2-methylpropoxy)phenyl]benzamide
CID 17074307
N-[4-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide
CID 17142469
N-[2-(2-methylpropoxy)phenyl]-3-(trifluoromethyl)benzamide
CID 14405584
4-ethoxy-N-[2-(2-methylpropoxy)phenyl]benzamide
CID 17074278
4-amino-N-[2-(2-methylpropoxy)phenyl]benzamide
CID 60927264
N-(2-cyanophenyl)-3-propan-2-yloxybenzamide
CID 924558
N-[2-[(2S)-butan-2-yl]phenyl]-3-(2-methylpropoxy)benzamide
CID 959928
N-(2-tert-butylphenyl)-3-propan-2-yloxybenzamide
CID 8779118
3-methyl-N-(2-propan-2-yloxyphenyl)benzamide
CID 17150877
N-[3-(2-phenoxyethoxy)phenyl]-3-propan-2-yloxybenzamide
CID 17142503
3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide
CID 55991701
N-[2-(difluoromethoxy)phenyl]-3-ethoxybenzamide
CID 934563

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide?
The IUPAC name of N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide (CID 17142483) is N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide.
What is the SMILES notation for N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide?
The canonical SMILES for N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide is CC(C)COc1ccccc1NC(=O)c1cccc(OC(C)C)c1.
What is the InChIKey of N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide?
The InChIKey is UUBHPSYBRYZXDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-14(2)13-23-19-11-6-5-10-18(19)21-20(22)16-8-7-9-17(12-16)24-15(3)4/h5-12,14-15H,13H2,1-4H3,(H,21,22).
What are the key properties of N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide?
N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide has a molecular weight of 327.42 g/mol, XLogP of 4.76, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide is sourced from PubChem (CID 17142483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).