N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide

C15H14ClN3O2 — CID 736092

IUPACN-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
InChIInChI=1S/C15H14ClN3O2/c1-10(20)17-12-5-7-13(8-6-12)18-15(21)19-14-4-2-3-11(16)9-14/h2-9H,1H3,(H,17,20)(H2,18,19,21)
InChIKeyBLYRTIVPDSDPJF-UHFFFAOYSA-N
MW303.75 g/mol
LogP3.94
Rot. Bonds3

About N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide

N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide (PubChem CID 736092) has the molecular formula C15H14ClN3O2 and a molecular weight of 303.75 g/mol. Its IUPAC name is N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide
PubChem CID736092
Molecular FormulaC15H14ClN3O2
Molecular Weight303.75 g/mol
Exact Mass303.08
IUPAC NameN-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
InChIInChI=1S/C15H14ClN3O2/c1-10(20)17-12-5-7-13(8-6-12)18-15(21)19-14-4-2-3-11(16)9-14/h2-9H,1H3,(H,17,20)(H2,18,19,21)
InChIKeyBLYRTIVPDSDPJF-UHFFFAOYSA-N
XLogP3.94
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.75
LogP ≤ 53.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide?
The IUPAC name of N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide (CID 736092) is N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide?
The canonical SMILES for N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide is CC(=O)Nc1ccc(NC(=O)Nc2cccc(Cl)c2)cc1.
What is the InChIKey of N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide?
The InChIKey is BLYRTIVPDSDPJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3O2/c1-10(20)17-12-5-7-13(8-6-12)18-15(21)19-14-4-2-3-11(16)9-14/h2-9H,1H3,(H,17,20)(H2,18,19,21).
What are the key properties of N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide?
N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide has a molecular weight of 303.75 g/mol, XLogP of 3.94, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-chlorophenyl)carbamoylamino]phenyl]acetamide is sourced from PubChem (CID 736092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).