2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide

C20H23N3O4 — CID 133204331

IUPAC2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide
SMILESCOc1ccccc1NC(=O)Nc1ccccc1C(=O)NCC1CCCO1
InChIInChI=1S/C20H23N3O4/c1-26-18-11-5-4-10-17(18)23-20(25)22-16-9-3-2-8-15(16)19(24)21-13-14-7-6-12-27-14/h2-5,8-11,14H,6-7,12-13H2,1H3,(H,21,24)(H2,22,23,25)
InChIKeyJISLRACTCITBKB-UHFFFAOYSA-N
MW369.42 g/mol
LogP3.25
Rot. Bonds6

About 2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide

2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide (PubChem CID 133204331) has the molecular formula C20H23N3O4 and a molecular weight of 369.42 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide
PubChem CID133204331
Molecular FormulaC20H23N3O4
Molecular Weight369.42 g/mol
Exact Mass369.17
IUPAC Name2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide
SMILESCOc1ccccc1NC(=O)Nc1ccccc1C(=O)NCC1CCCO1
InChIInChI=1S/C20H23N3O4/c1-26-18-11-5-4-10-17(18)23-20(25)22-16-9-3-2-8-15(16)19(24)21-13-14-7-6-12-27-14/h2-5,8-11,14H,6-7,12-13H2,1H3,(H,21,24)(H2,22,23,25)
InChIKeyJISLRACTCITBKB-UHFFFAOYSA-N
XLogP3.25
TPSA88.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 53.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2,3-dimethoxy-N-(oxolan-2-ylmethyl)benzamide
CID 4781408
2-(2-methoxyanilino)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 51250549
methyl 4-oxo-4-[2-[[(2R)-oxolan-2-yl]methylcarbamoyl]anilino]butanoate
CID 7248308
2-methyl-3-oxo-3-[2-(oxolan-2-ylmethylcarbamoyl)anilino]propanoic acid
CID 154795586
2-[[(2R)-2-chloropropanoyl]amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 92660378
2-[[(2S)-2-(2-ethylphenoxy)propanoyl]amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 30380376
2-[(4-fluorobenzoyl)amino]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 7378690
1-(2-methoxyphenyl)-3-(oxolan-2-ylmethyl)thiourea
CID 2910234
2-[[2-(2-methylpropoxy)benzoyl]amino]-N-(oxolan-2-ylmethyl)benzamide
CID 4945492
2-[[2-(2-methylpropoxy)benzoyl]amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 9206549
3,5-dichloro-4-methoxy-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide
CID 17361831
N-[[(2S)-oxolan-2-yl]methyl]-2-[[(2R)-2-(2-propan-2-ylphenoxy)propanoyl]amino]benzamide
CID 30393276

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide?
The IUPAC name of 2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide (CID 133204331) is 2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide.
What is the SMILES notation for 2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide?
The canonical SMILES for 2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide is COc1ccccc1NC(=O)Nc1ccccc1C(=O)NCC1CCCO1.
What is the InChIKey of 2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide?
The InChIKey is JISLRACTCITBKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O4/c1-26-18-11-5-4-10-17(18)23-20(25)22-16-9-3-2-8-15(16)19(24)21-13-14-7-6-12-27-14/h2-5,8-11,14H,6-7,12-13H2,1H3,(H,21,24)(H2,22,23,25).
What are the key properties of 2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide?
2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide has a molecular weight of 369.42 g/mol, XLogP of 3.25, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)carbamoylamino]-N-(oxolan-2-ylmethyl)benzamide is sourced from PubChem (CID 133204331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).