N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide

C19H22N2O3 — CID 3622603

IUPACN-(3-methoxyphenyl)-4-(pentanoylamino)benzamide
SMILESCCCCC(=O)Nc1ccc(C(=O)Nc2cccc(OC)c2)cc1
InChIInChI=1S/C19H22N2O3/c1-3-4-8-18(22)20-15-11-9-14(10-12-15)19(23)21-16-6-5-7-17(13-16)24-2/h5-7,9-13H,3-4,8H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyYCKZRANCPMENFE-UHFFFAOYSA-N
MW326.40 g/mol
LogP4.08
Rot. Bonds7

About N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide

N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide (PubChem CID 3622603) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-4-(pentanoylamino)benzamide
PubChem CID3622603
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-(3-methoxyphenyl)-4-(pentanoylamino)benzamide
SMILESCCCCC(=O)Nc1ccc(C(=O)Nc2cccc(OC)c2)cc1
InChIInChI=1S/C19H22N2O3/c1-3-4-8-18(22)20-15-11-9-14(10-12-15)19(23)21-16-6-5-7-17(13-16)24-2/h5-7,9-13H,3-4,8H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyYCKZRANCPMENFE-UHFFFAOYSA-N
XLogP4.08
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-methoxyanilino)-2-oxoethyl]pentanamide
CID 112998618
4-hexoxy-N-(3-methoxyphenyl)benzamide
CID 4933605
2,6-dimethoxy-N-[3-(pentanoylamino)phenyl]benzamide
CID 21229671
N-[3-(pentanoylamino)phenyl]-4-(phenoxymethyl)benzamide
CID 2187605
4-butoxy-N-[3-(hexanoylamino)phenyl]benzamide
CID 26161284
N-[3-(hexanoylamino)phenyl]-4-(2-methoxyethoxy)benzamide
CID 26161346
4-(dodecanoylamino)-N-phenylbenzamide
CID 5109500
N-(4-methylphenyl)-4-(pentanoylamino)benzamide
CID 4630697
4-acetyl-N-(3-methoxyphenyl)benzamide
CID 16640996
N-[3-(hexanoylamino)phenyl]-4-propoxybenzamide
CID 26161290
4-butoxy-3-methoxy-N-(3-methoxyphenyl)benzamide
CID 26914609
1-N-[4-(dimethylamino)phenyl]-4-N-(3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109050069

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide?
The IUPAC name of N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide (CID 3622603) is N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide.
What is the SMILES notation for N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide?
The canonical SMILES for N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide is CCCCC(=O)Nc1ccc(C(=O)Nc2cccc(OC)c2)cc1.
What is the InChIKey of N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide?
The InChIKey is YCKZRANCPMENFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-3-4-8-18(22)20-15-11-9-14(10-12-15)19(23)21-16-6-5-7-17(13-16)24-2/h5-7,9-13H,3-4,8H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide?
N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide has a molecular weight of 326.40 g/mol, XLogP of 4.08, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-4-(pentanoylamino)benzamide is sourced from PubChem (CID 3622603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).