N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide

C24H25N3O2 — CID 31957316

IUPACN-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide
SMILESCC(=O)Nc1cccc(NC(=O)NCCC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C24H25N3O2/c1-18(28)26-21-13-8-14-22(17-21)27-24(29)25-16-15-23(19-9-4-2-5-10-19)20-11-6-3-7-12-20/h2-14,17,23H,15-16H2,1H3,(H,26,28)(H2,25,27,29)
InChIKeyLVMHZQDKNJEDPX-UHFFFAOYSA-N
MW387.48 g/mol
LogP4.99
Rot. Bonds7

About N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide

N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide (PubChem CID 31957316) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide
PubChem CID31957316
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC NameN-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide
SMILESCC(=O)Nc1cccc(NC(=O)NCCC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C24H25N3O2/c1-18(28)26-21-13-8-14-22(17-21)27-24(29)25-16-15-23(19-9-4-2-5-10-19)20-11-6-3-7-12-20/h2-14,17,23H,15-16H2,1H3,(H,26,28)(H2,25,27,29)
InChIKeyLVMHZQDKNJEDPX-UHFFFAOYSA-N
XLogP4.99
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 54.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide?
The IUPAC name of N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide (CID 31957316) is N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide.
What is the SMILES notation for N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide?
The canonical SMILES for N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide is CC(=O)Nc1cccc(NC(=O)NCCC(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide?
The InChIKey is LVMHZQDKNJEDPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-18(28)26-21-13-8-14-22(17-21)27-24(29)25-16-15-23(19-9-4-2-5-10-19)20-11-6-3-7-12-20/h2-14,17,23H,15-16H2,1H3,(H,26,28)(H2,25,27,29).
What are the key properties of N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide?
N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide has a molecular weight of 387.48 g/mol, XLogP of 4.99, 7 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3,3-diphenylpropylcarbamoylamino)phenyl]acetamide is sourced from PubChem (CID 31957316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).