N-(3-methoxyphenyl)-4-propan-2-ylbenzamide

C17H19NO2 — CID 897049

IUPACN-(3-methoxyphenyl)-4-propan-2-ylbenzamide
SMILESCOc1cccc(NC(=O)c2ccc(C(C)C)cc2)c1
InChIInChI=1S/C17H19NO2/c1-12(2)13-7-9-14(10-8-13)17(19)18-15-5-4-6-16(11-15)20-3/h4-12H,1-3H3,(H,18,19)
InChIKeyJKOVWILESIAMFA-UHFFFAOYSA-N
MW269.34 g/mol
LogP4.07
Rot. Bonds4

About N-(3-methoxyphenyl)-4-propan-2-ylbenzamide

N-(3-methoxyphenyl)-4-propan-2-ylbenzamide (PubChem CID 897049) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-4-propan-2-ylbenzamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-4-propan-2-ylbenzamide
PubChem CID897049
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-(3-methoxyphenyl)-4-propan-2-ylbenzamide
SMILESCOc1cccc(NC(=O)c2ccc(C(C)C)cc2)c1
InChIInChI=1S/C17H19NO2/c1-12(2)13-7-9-14(10-8-13)17(19)18-15-5-4-6-16(11-15)20-3/h4-12H,1-3H3,(H,18,19)
InChIKeyJKOVWILESIAMFA-UHFFFAOYSA-N
XLogP4.07
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-acetyl-N-(3-methoxyphenyl)benzamide
CID 16640996
N-(3-methoxyphenyl)-4-[(E)-3-methylbut-1-enyl]benzamide
CID 59811250
N-(3-chlorophenyl)-4-propan-2-ylbenzamide
CID 1406456
3,5-dimethoxy-N-(3-propan-2-ylphenyl)benzamide
CID 24636290
4-(aminomethyl)-N-(3-methoxyphenyl)benzamide
CID 16796099
N-(3-heptoxyphenyl)-4-propan-2-ylbenzamide
CID 17177482
4-propan-2-yloxy-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154760
4-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)benzamide
CID 16651154
N-(3-methoxyphenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 41363704
4-(methanesulfonamido)-N-(3-methoxyphenyl)benzamide
CID 958689
1-N-[4-(dimethylamino)phenyl]-4-N-(3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109050069
4-[(3-methoxyphenyl)carbamoylamino]-N-propan-2-ylbenzamide
CID 17180581

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-4-propan-2-ylbenzamide?
The IUPAC name of N-(3-methoxyphenyl)-4-propan-2-ylbenzamide (CID 897049) is N-(3-methoxyphenyl)-4-propan-2-ylbenzamide.
What is the SMILES notation for N-(3-methoxyphenyl)-4-propan-2-ylbenzamide?
The canonical SMILES for N-(3-methoxyphenyl)-4-propan-2-ylbenzamide is COc1cccc(NC(=O)c2ccc(C(C)C)cc2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-4-propan-2-ylbenzamide?
The InChIKey is JKOVWILESIAMFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-12(2)13-7-9-14(10-8-13)17(19)18-15-5-4-6-16(11-15)20-3/h4-12H,1-3H3,(H,18,19).
What are the key properties of N-(3-methoxyphenyl)-4-propan-2-ylbenzamide?
N-(3-methoxyphenyl)-4-propan-2-ylbenzamide has a molecular weight of 269.34 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-4-propan-2-ylbenzamide is sourced from PubChem (CID 897049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).