N-[4-(heptanoylamino)phenyl]benzamide

C20H24N2O2 — CID 54789055

IUPACN-[4-(heptanoylamino)phenyl]benzamide
SMILESCCCCCCC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C20H24N2O2/c1-2-3-4-8-11-19(23)21-17-12-14-18(15-13-17)22-20(24)16-9-6-5-7-10-16/h5-7,9-10,12-15H,2-4,8,11H2,1H3,(H,21,23)(H,22,24)
InChIKeySXBMKGUFJJVOMZ-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.85
Rot. Bonds8

About N-[4-(heptanoylamino)phenyl]benzamide

N-[4-(heptanoylamino)phenyl]benzamide (PubChem CID 54789055) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-[4-(heptanoylamino)phenyl]benzamide.

Molecular Properties

Compound NameN-[4-(heptanoylamino)phenyl]benzamide
PubChem CID54789055
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-[4-(heptanoylamino)phenyl]benzamide
SMILESCCCCCCC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1
InChIInChI=1S/C20H24N2O2/c1-2-3-4-8-11-19(23)21-17-12-14-18(15-13-17)22-20(24)16-9-6-5-7-10-16/h5-7,9-10,12-15H,2-4,8,11H2,1H3,(H,21,23)(H,22,24)
InChIKeySXBMKGUFJJVOMZ-UHFFFAOYSA-N
XLogP4.85
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(dodecanoylamino)-N-phenylbenzamide
CID 5109500
N,N'-bis(4-benzamidophenyl)hexanediamide
CID 17235924
N-phenylpentacosanamide
CID 19025260
N-phenylheptatetracontanamide
CID 150503307
N-[4-(icosanoylamino)phenyl]icosanamide
CID 101291044
N-(2-chlorophenyl)-4-(octanoylamino)benzamide
CID 171980600
2-[[4-(hexanoylamino)benzoyl]amino]benzoic acid
CID 3756720
4-(decanoylamino)-N-(2,6-dimethylphenyl)benzamide
CID 3669912
N-[4-[(E)-2-phenylethenyl]phenyl]dodecanamide
CID 127035783
4-(pentanoylamino)-N-(1-phenylhexylideneamino)benzamide
CID 4926193
formamide;N-phenylheptanamide
CID 143464966
5-oxo-N-phenylheptadecanamide
CID 3308902

Frequently Asked Questions

What is the IUPAC name of N-[4-(heptanoylamino)phenyl]benzamide?
The IUPAC name of N-[4-(heptanoylamino)phenyl]benzamide (CID 54789055) is N-[4-(heptanoylamino)phenyl]benzamide.
What is the SMILES notation for N-[4-(heptanoylamino)phenyl]benzamide?
The canonical SMILES for N-[4-(heptanoylamino)phenyl]benzamide is CCCCCCC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-[4-(heptanoylamino)phenyl]benzamide?
The InChIKey is SXBMKGUFJJVOMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-2-3-4-8-11-19(23)21-17-12-14-18(15-13-17)22-20(24)16-9-6-5-7-10-16/h5-7,9-10,12-15H,2-4,8,11H2,1H3,(H,21,23)(H,22,24).
What are the key properties of N-[4-(heptanoylamino)phenyl]benzamide?
N-[4-(heptanoylamino)phenyl]benzamide has a molecular weight of 324.42 g/mol, XLogP of 4.85, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(heptanoylamino)phenyl]benzamide is sourced from PubChem (CID 54789055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).