4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide

C19H20N2O4 — CID 4786441

IUPAC4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide
SMILESNC(=O)c1ccc(NC(=O)c2ccc(OCC3CCCO3)cc2)cc1
InChIInChI=1S/C19H20N2O4/c20-18(22)13-3-7-15(8-4-13)21-19(23)14-5-9-16(10-6-14)25-12-17-2-1-11-24-17/h3-10,17H,1-2,11-12H2,(H2,20,22)(H,21,23)
InChIKeyFVNLCUALWIAMPD-UHFFFAOYSA-N
MW340.38 g/mol
LogP2.60
Rot. Bonds6

About 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide

4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide (PubChem CID 4786441) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide.

Molecular Properties

Compound Name4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide
PubChem CID4786441
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide
SMILESNC(=O)c1ccc(NC(=O)c2ccc(OCC3CCCO3)cc2)cc1
InChIInChI=1S/C19H20N2O4/c20-18(22)13-3-7-15(8-4-13)21-19(23)14-5-9-16(10-6-14)25-12-17-2-1-11-24-17/h3-10,17H,1-2,11-12H2,(H2,20,22)(H,21,23)
InChIKeyFVNLCUALWIAMPD-UHFFFAOYSA-N
XLogP2.60
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetamidophenyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 40642293
4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 2541314
4-methyl-N-[4-(oxolan-2-ylmethoxy)phenyl]benzamide
CID 4957909
methyl 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzoate
CID 17222269
4-(2-methoxyethoxy)-N-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]benzamide
CID 40796712
N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]-4-phenylbenzamide
CID 9294955
N-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]pyridine-4-carboxamide
CID 7447165
4-[[(2S)-oxolan-2-yl]methoxy]-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 7987635
4-(oxolan-2-ylmethoxy)-N-[4-(2,2,2-trifluoroethoxy)phenyl]benzamide
CID 16580872
4-(oxolan-2-ylmethoxy)-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 4795558
N-[4-(methanesulfonamido)phenyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 36818148
N-(3,4-dimethylphenyl)-4-[[(2S)-oxolan-2-yl]methoxy]benzamide
CID 42580258

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide?
The IUPAC name of 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide (CID 4786441) is 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide.
What is the SMILES notation for 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide?
The canonical SMILES for 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide is NC(=O)c1ccc(NC(=O)c2ccc(OCC3CCCO3)cc2)cc1.
What is the InChIKey of 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide?
The InChIKey is FVNLCUALWIAMPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c20-18(22)13-3-7-15(8-4-13)21-19(23)14-5-9-16(10-6-14)25-12-17-2-1-11-24-17/h3-10,17H,1-2,11-12H2,(H2,20,22)(H,21,23).
What are the key properties of 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide?
4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide has a molecular weight of 340.38 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide is sourced from PubChem (CID 4786441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).