N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide

C21H23N3O4 — CID 108551397

IUPACN-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide
SMILESCC(=O)Nc1cccc(C(=O)N2CCC(NC(=O)c3ccccc3O)CC2)c1
InChIInChI=1S/C21H23N3O4/c1-14(25)22-17-6-4-5-15(13-17)21(28)24-11-9-16(10-12-24)23-20(27)18-7-2-3-8-19(18)26/h2-8,13,16,26H,9-12H2,1H3,(H,22,25)(H,23,27)
InChIKeyHZTNIOLHUUVQSY-UHFFFAOYSA-N
MW381.43 g/mol
LogP2.39
Rot. Bonds4

About N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide

N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide (PubChem CID 108551397) has the molecular formula C21H23N3O4 and a molecular weight of 381.43 g/mol. Its IUPAC name is N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide
PubChem CID108551397
Molecular FormulaC21H23N3O4
Molecular Weight381.43 g/mol
Exact Mass381.17
IUPAC NameN-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide
SMILESCC(=O)Nc1cccc(C(=O)N2CCC(NC(=O)c3ccccc3O)CC2)c1
InChIInChI=1S/C21H23N3O4/c1-14(25)22-17-6-4-5-15(13-17)21(28)24-11-9-16(10-12-24)23-20(27)18-7-2-3-8-19(18)26/h2-8,13,16,26H,9-12H2,1H3,(H,22,25)(H,23,27)
InChIKeyHZTNIOLHUUVQSY-UHFFFAOYSA-N
XLogP2.39
TPSA98.74 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.43
LogP ≤ 52.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108558184
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-fluorobenzamide
CID 32508951
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551288
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide
CID 108548929
N-[1-(3,5-dihydroxybenzoyl)piperidin-4-yl]-2-hydroxybenzamide
CID 108551443
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-ethylbutanamide
CID 108555614
3-acetamido-N-[1-(2,5-dichlorobenzoyl)piperidin-4-yl]benzamide
CID 108553848
4-(3-acetamidobenzoyl)-N-cyclopentylpiperazine-1-carboxamide
CID 110812202
N-[1-(4-bromobenzoyl)piperidin-4-yl]-2-hydroxybenzamide
CID 108551354
2-chloroethyl N-[1-(3-acetamidobenzoyl)piperidin-4-yl]carbamate
CID 108565532
N-[1-(3-hydroxybenzoyl)piperidin-4-yl]-2-sulfanylbenzamide
CID 108554761
N-[3-[4-(2-methylbenzoyl)piperazine-1-carbonyl]phenyl]acetamide
CID 110365637

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide?
The IUPAC name of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide (CID 108551397) is N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide.
What is the SMILES notation for N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide?
The canonical SMILES for N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide is CC(=O)Nc1cccc(C(=O)N2CCC(NC(=O)c3ccccc3O)CC2)c1.
What is the InChIKey of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide?
The InChIKey is HZTNIOLHUUVQSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O4/c1-14(25)22-17-6-4-5-15(13-17)21(28)24-11-9-16(10-12-24)23-20(27)18-7-2-3-8-19(18)26/h2-8,13,16,26H,9-12H2,1H3,(H,22,25)(H,23,27).
What are the key properties of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide?
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide has a molecular weight of 381.43 g/mol, XLogP of 2.39, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide is sourced from PubChem (CID 108551397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).