N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide

C24H25NO2 — CID 8778703

IUPACN-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide
SMILESCC[C@@H](C)c1ccc(NC(=O)c2cccc(OCc3ccccc3)c2)cc1
InChIInChI=1S/C24H25NO2/c1-3-18(2)20-12-14-22(15-13-20)25-24(26)21-10-7-11-23(16-21)27-17-19-8-5-4-6-9-19/h4-16,18H,3,17H2,1-2H3,(H,25,26)/t18-/m1/s1
InChIKeyZIVOPIMYNUAPRS-GOSISDBHSA-N
MW359.47 g/mol
LogP6.03
Rot. Bonds7

About N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide

N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide (PubChem CID 8778703) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide
PubChem CID8778703
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC NameN-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide
SMILESCC[C@@H](C)c1ccc(NC(=O)c2cccc(OCc3ccccc3)c2)cc1
InChIInChI=1S/C24H25NO2/c1-3-18(2)20-12-14-22(15-13-20)25-24(26)21-10-7-11-23(16-21)27-17-19-8-5-4-6-9-19/h4-16,18H,3,17H2,1-2H3,(H,25,26)/t18-/m1/s1
InChIKeyZIVOPIMYNUAPRS-GOSISDBHSA-N
XLogP6.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 56.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(2-methylpropoxy)phenyl]-3-phenylmethoxybenzamide
CID 17148534
3-benzamido-N-(4-butan-2-ylphenyl)benzamide
CID 5224241
N-[4-(dimethylamino)phenyl]-3-phenylmethoxybenzamide
CID 23733067
4-benzamido-N-(4-butan-2-ylphenyl)benzamide
CID 17153198
[3-[(4-phenylmethoxyphenyl)carbamoyl]phenyl] acetate
CID 2995401
3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
3-phenylmethoxy-N-(4-sulfamoylphenyl)benzamide
CID 1163178
N-(3,4-dichlorophenyl)-3-phenylmethoxybenzamide
CID 17148514
3-phenylmethoxy-N-[(1S)-1-phenylpropyl]benzamide
CID 93234582
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide
CID 26522423
3-amino-N-(4-butan-2-ylphenyl)benzamide
CID 20667037
3-[(3-methylphenyl)methoxy]-N-[4-(2-methylpropanoylamino)phenyl]benzamide
CID 46517813

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide?
The IUPAC name of N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide (CID 8778703) is N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide.
What is the SMILES notation for N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide?
The canonical SMILES for N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide is CC[C@@H](C)c1ccc(NC(=O)c2cccc(OCc3ccccc3)c2)cc1.
What is the InChIKey of N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide?
The InChIKey is ZIVOPIMYNUAPRS-GOSISDBHSA-N. The full InChI is InChI=1S/C24H25NO2/c1-3-18(2)20-12-14-22(15-13-20)25-24(26)21-10-7-11-23(16-21)27-17-19-8-5-4-6-9-19/h4-16,18H,3,17H2,1-2H3,(H,25,26)/t18-/m1/s1.
What are the key properties of N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide?
N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide has a molecular weight of 359.47 g/mol, XLogP of 6.03, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2R)-butan-2-yl]phenyl]-3-phenylmethoxybenzamide is sourced from PubChem (CID 8778703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).