4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide

C19H23N3O4 — CID 51118545

IUPAC4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide
SMILESCOc1ccc(C(=O)NCCNC(=O)Nc2cc(C)ccc2OC)cc1
InChIInChI=1S/C19H23N3O4/c1-13-4-9-17(26-3)16(12-13)22-19(24)21-11-10-20-18(23)14-5-7-15(25-2)8-6-14/h4-9,12H,10-11H2,1-3H3,(H,20,23)(H2,21,22,24)
InChIKeyRIPNZRCMUJTTDY-UHFFFAOYSA-N
MW357.41 g/mol
LogP2.56
Rot. Bonds7

About 4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide

4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide (PubChem CID 51118545) has the molecular formula C19H23N3O4 and a molecular weight of 357.41 g/mol. Its IUPAC name is 4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide
PubChem CID51118545
Molecular FormulaC19H23N3O4
Molecular Weight357.41 g/mol
Exact Mass357.17
IUPAC Name4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide
SMILESCOc1ccc(C(=O)NCCNC(=O)Nc2cc(C)ccc2OC)cc1
InChIInChI=1S/C19H23N3O4/c1-13-4-9-17(26-3)16(12-13)22-19(24)21-11-10-20-18(23)14-5-7-15(25-2)8-6-14/h4-9,12H,10-11H2,1-3H3,(H,20,23)(H2,21,22,24)
InChIKeyRIPNZRCMUJTTDY-UHFFFAOYSA-N
XLogP2.56
TPSA88.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 52.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide (CID 51118545) is 4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide is COc1ccc(C(=O)NCCNC(=O)Nc2cc(C)ccc2OC)cc1.
What is the InChIKey of 4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide?
The InChIKey is RIPNZRCMUJTTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4/c1-13-4-9-17(26-3)16(12-13)22-19(24)21-11-10-20-18(23)14-5-7-15(25-2)8-6-14/h4-9,12H,10-11H2,1-3H3,(H,20,23)(H2,21,22,24).
What are the key properties of 4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide?
4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide has a molecular weight of 357.41 g/mol, XLogP of 2.56, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-[(2-methoxy-5-methylphenyl)carbamoylamino]ethyl]benzamide is sourced from PubChem (CID 51118545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).