4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide

C24H25N3O3 — CID 143491833

IUPAC4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(Oc3ccc(NC(=O)NC(C)C)cc3)cc2)cc1
InChIInChI=1S/C24H25N3O3/c1-16(2)25-24(29)27-20-10-14-22(15-11-20)30-21-12-8-19(9-13-21)26-23(28)18-6-4-17(3)5-7-18/h4-16H,1-3H3,(H,26,28)(H2,25,27,29)
InChIKeyPHDFNTWXEAUEOO-UHFFFAOYSA-N
MW403.48 g/mol
LogP5.57
Rot. Bonds6

About 4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide

4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide (PubChem CID 143491833) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is 4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide
PubChem CID143491833
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC Name4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide
SMILESCc1ccc(C(=O)Nc2ccc(Oc3ccc(NC(=O)NC(C)C)cc3)cc2)cc1
InChIInChI=1S/C24H25N3O3/c1-16(2)25-24(29)27-20-10-14-22(15-11-20)30-21-12-8-19(9-13-21)26-23(28)18-6-4-17(3)5-7-18/h4-16H,1-3H3,(H,26,28)(H2,25,27,29)
InChIKeyPHDFNTWXEAUEOO-UHFFFAOYSA-N
XLogP5.57
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.48
LogP ≤ 55.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxyphenyl)-4-(4-methylphenoxy)benzamide
CID 16651033
4-acetamido-N-[4-(propan-2-ylcarbamoylamino)phenyl]benzamide
CID 38166611
N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide
CID 16651045
N-[4-(2-methylpropanoylamino)phenyl]-4-(propan-2-ylcarbamoylamino)benzamide
CID 55824637
N-[4-(4-methylphenoxy)phenyl]-4-(trifluoromethoxy)benzamide
CID 7925236
4-ethyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]benzamide
CID 38175728
4-(methoxymethyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]benzamide
CID 38196484
1-(4-methoxyphenyl)-3-propan-2-ylurea
CID 4616042
4-(cyclopropanecarbonylamino)-N-[4-(propan-2-ylcarbamoylamino)phenyl]benzamide
CID 38166430
(4-methylphenyl) 4-[(4-methylbenzoyl)amino]benzoate
CID 71408981
propan-2-yl 4-[(4-methylbenzoyl)amino]benzoate
CID 718345
N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide
CID 16651108

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide?
The IUPAC name of 4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide (CID 143491833) is 4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide.
What is the SMILES notation for 4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide?
The canonical SMILES for 4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide is Cc1ccc(C(=O)Nc2ccc(Oc3ccc(NC(=O)NC(C)C)cc3)cc2)cc1.
What is the InChIKey of 4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide?
The InChIKey is PHDFNTWXEAUEOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-16(2)25-24(29)27-20-10-14-22(15-11-20)30-21-12-8-19(9-13-21)26-23(28)18-6-4-17(3)5-7-18/h4-16H,1-3H3,(H,26,28)(H2,25,27,29).
What are the key properties of 4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide?
4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide has a molecular weight of 403.48 g/mol, XLogP of 5.57, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[4-[4-(propan-2-ylcarbamoylamino)phenoxy]phenyl]benzamide is sourced from PubChem (CID 143491833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).