N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide

C18H18Cl2N2O2 — CID 4630686

IUPACN-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide
SMILESCCCCC(=O)Nc1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2)cc1
InChIInChI=1S/C18H18Cl2N2O2/c1-2-3-4-17(23)21-15-7-5-12(6-8-15)18(24)22-16-10-13(19)9-14(20)11-16/h5-11H,2-4H2,1H3,(H,21,23)(H,22,24)
InChIKeyFCCVEFCSPFCKIJ-UHFFFAOYSA-N
MW365.26 g/mol
LogP5.37
Rot. Bonds6

About N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide

N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide (PubChem CID 4630686) has the molecular formula C18H18Cl2N2O2 and a molecular weight of 365.26 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide
PubChem CID4630686
Molecular FormulaC18H18Cl2N2O2
Molecular Weight365.26 g/mol
Exact Mass364.07
IUPAC NameN-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide
SMILESCCCCC(=O)Nc1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2)cc1
InChIInChI=1S/C18H18Cl2N2O2/c1-2-3-4-17(23)21-15-7-5-12(6-8-15)18(24)22-16-10-13(19)9-14(20)11-16/h5-11H,2-4H2,1H3,(H,21,23)(H,22,24)
InChIKeyFCCVEFCSPFCKIJ-UHFFFAOYSA-N
XLogP5.37
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.26
LogP ≤ 55.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-methylphenyl)-4-(pentanoylamino)benzamide
CID 4630697
N-(3,5-dichlorophenyl)nonanamide
CID 3459184
N-[4-[[(3-chlorobenzoyl)amino]carbamoyl]phenyl]pentanamide
CID 4940346
4-(dodecanoylamino)-N-phenylbenzamide
CID 5109500
4-N-(3,5-dichlorophenyl)-1-N-propylbenzene-1,4-dicarboxamide
CID 109043049
N-[4-[[[6-oxo-6-[2-[4-(pentanoylamino)benzoyl]hydrazinyl]hexanoyl]amino]carbamoyl]phenyl]pentanamide
CID 4926555
N-(2-chlorophenyl)-4-(octanoylamino)benzamide
CID 171980600
N-(3,5-dichlorophenyl)-4-hexoxybenzamide
CID 4933557
N-(3,5-dichlorophenyl)-4-heptoxybenzamide
CID 4950610
N-[4-[(hexanoylamino)carbamoyl]phenyl]pentanamide
CID 4953980
N-[4-(heptanoylamino)phenyl]benzamide
CID 54789055
N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide
CID 3622603

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide?
The IUPAC name of N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide (CID 4630686) is N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide is CCCCC(=O)Nc1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2)cc1.
What is the InChIKey of N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide?
The InChIKey is FCCVEFCSPFCKIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O2/c1-2-3-4-17(23)21-15-7-5-12(6-8-15)18(24)22-16-10-13(19)9-14(20)11-16/h5-11H,2-4H2,1H3,(H,21,23)(H,22,24).
What are the key properties of N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide?
N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide has a molecular weight of 365.26 g/mol, XLogP of 5.37, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-4-(pentanoylamino)benzamide is sourced from PubChem (CID 4630686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).