benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide

C28H27ClN2O4 — CID 161282145

IUPACbenzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(Cl)cc1.COc1ccc(NC(=O)c2ccccc2)cc1.NC(=O)c1ccccc1
InChIInChI=1S/C14H13NO2.C7H7ClO.C7H7NO/c1-17-13-9-7-12(8-10-13)15-14(16)11-5-3-2-4-6-11;1-9-7-4-2-6(8)3-5-7;8-7(9)6-4-2-1-3-5-6/h2-10H,1H3,(H,15,16);2-5H,1H3;1-5H,(H2,8,9)
InChIKeyVFFRSUGNEFNJBC-UHFFFAOYSA-N
MW490.99 g/mol
LogP6.08
Rot. Bonds5

About benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide

benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide (PubChem CID 161282145) has the molecular formula C28H27ClN2O4 and a molecular weight of 490.99 g/mol. Its IUPAC name is benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide.

Molecular Properties

Compound Namebenzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide
PubChem CID161282145
Molecular FormulaC28H27ClN2O4
Molecular Weight490.99 g/mol
Exact Mass490.17
IUPAC Namebenzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(Cl)cc1.COc1ccc(NC(=O)c2ccccc2)cc1.NC(=O)c1ccccc1
InChIInChI=1S/C14H13NO2.C7H7ClO.C7H7NO/c1-17-13-9-7-12(8-10-13)15-14(16)11-5-3-2-4-6-11;1-9-7-4-2-6(8)3-5-7;8-7(9)6-4-2-1-3-5-6/h2-10H,1H3,(H,15,16);2-5H,1H3;1-5H,(H2,8,9)
InChIKeyVFFRSUGNEFNJBC-UHFFFAOYSA-N
XLogP6.08
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500490.99
LogP ≤ 56.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzamide;1-chloro-4-methylbenzene;methane;N-(4-methylphenyl)benzamide
CID 158954250
N-(4-chlorophenyl)-4-(4-methoxyphenoxy)benzamide
CID 16651140
N-[4-[[(4-methoxybenzoyl)amino]carbamoyl]phenyl]benzamide
CID 1246678
N-(4-chlorophenyl)benzamide;hydrochloride
CID 139912610
(4-benzamidophenyl) 4-carbamoylbenzoate
CID 35623223
1-N-[(4-chlorophenyl)methyl]-4-N-(4-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109047359
N-(4-anilinophenyl)-4-chlorobenzamide
CID 681104
N-[4-[[(4-chlorobenzoyl)amino]carbamoyl]phenyl]benzamide
CID 1100705
(E)-N-(4-chlorophenyl)-3-(4-methoxyphenyl)-2-phenylprop-2-enamide
CID 1316041
(Z)-N-(4-chlorophenyl)-3-(4-methoxyphenyl)-2-phenylprop-2-enamide
CID 1316043
4-[[(2R)-2-[4-[(4-methoxyphenyl)carbamoyl]anilino]propanoyl]amino]benzamide
CID 41190635
4-[(4-chlorobenzoyl)amino]-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide
CID 4633062

Frequently Asked Questions

What is the IUPAC name of benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide?
The IUPAC name of benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide (CID 161282145) is benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide.
What is the SMILES notation for benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide?
The canonical SMILES for benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide is COc1ccc(Cl)cc1.COc1ccc(NC(=O)c2ccccc2)cc1.NC(=O)c1ccccc1.
What is the InChIKey of benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide?
The InChIKey is VFFRSUGNEFNJBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2.C7H7ClO.C7H7NO/c1-17-13-9-7-12(8-10-13)15-14(16)11-5-3-2-4-6-11;1-9-7-4-2-6(8)3-5-7;8-7(9)6-4-2-1-3-5-6/h2-10H,1H3,(H,15,16);2-5H,1H3;1-5H,(H2,8,9).
What are the key properties of benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide?
benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide has a molecular weight of 490.99 g/mol, XLogP of 6.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzamide;1-chloro-4-methoxybenzene;N-(4-methoxyphenyl)benzamide is sourced from PubChem (CID 161282145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).