3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide

C20H20Cl2N2O4 — CID 17361831

IUPAC3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide
SMILESCOc1c(Cl)cc(C(=O)Nc2ccccc2C(=O)NCC2CCCO2)cc1Cl
InChIInChI=1S/C20H20Cl2N2O4/c1-27-18-15(21)9-12(10-16(18)22)19(25)24-17-7-3-2-6-14(17)20(26)23-11-13-5-4-8-28-13/h2-3,6-7,9-10,13H,4-5,8,11H2,1H3,(H,23,26)(H,24,25)
InChIKeyDGIJBKQHMMNZKV-UHFFFAOYSA-N
MW423.30 g/mol
LogP4.16
Rot. Bonds6

About 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide

3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide (PubChem CID 17361831) has the molecular formula C20H20Cl2N2O4 and a molecular weight of 423.30 g/mol. Its IUPAC name is 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide
PubChem CID17361831
Molecular FormulaC20H20Cl2N2O4
Molecular Weight423.30 g/mol
Exact Mass422.08
IUPAC Name3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide
SMILESCOc1c(Cl)cc(C(=O)Nc2ccccc2C(=O)NCC2CCCO2)cc1Cl
InChIInChI=1S/C20H20Cl2N2O4/c1-27-18-15(21)9-12(10-16(18)22)19(25)24-17-7-3-2-6-14(17)20(26)23-11-13-5-4-8-28-13/h2-3,6-7,9-10,13H,4-5,8,11H2,1H3,(H,23,26)(H,24,25)
InChIKeyDGIJBKQHMMNZKV-UHFFFAOYSA-N
XLogP4.16
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.30
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]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

2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 7378718
2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide
CID 133204331
2-[(4-fluorobenzoyl)amino]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 7378690
2-[(2-chlorobenzoyl)carbamothioylamino]-N-(oxolan-2-ylmethyl)benzamide
CID 4935508
2-chloro-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 668841
N-[2-[[(2R)-oxolan-2-yl]methylcarbamoyl]phenyl]naphthalene-1-carboxamide
CID 1319633
3-benzamido-4-methyl-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide
CID 17226585
2-[[2-[[(2R)-oxolan-2-yl]methylcarbamoyl]phenyl]carbamoyl]benzoic acid
CID 7471264
methyl 4-oxo-4-[2-[[(2R)-oxolan-2-yl]methylcarbamoyl]anilino]butanoate
CID 7248308
2-[[(2R)-2-chloropropanoyl]amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 92660378
2-[[2-(2-bromo-4,6-dichlorophenoxy)acetyl]amino]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 41208350
2-[[3-(methylsulfamoyl)benzoyl]amino]-N-(oxolan-2-ylmethyl)benzamide
CID 133231300

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide?
The IUPAC name of 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide (CID 17361831) is 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide is COc1c(Cl)cc(C(=O)Nc2ccccc2C(=O)NCC2CCCO2)cc1Cl.
What is the InChIKey of 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide?
The InChIKey is DGIJBKQHMMNZKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20Cl2N2O4/c1-27-18-15(21)9-12(10-16(18)22)19(25)24-17-7-3-2-6-14(17)20(26)23-11-13-5-4-8-28-13/h2-3,6-7,9-10,13H,4-5,8,11H2,1H3,(H,23,26)(H,24,25).
What are the key properties of 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide?
3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide has a molecular weight of 423.30 g/mol, XLogP of 4.16, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 17361831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).