N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide

C22H25N3O4 — CID 43814135

IUPACN-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
SMILESCOc1ccc(C(=O)NC2CCN(C(=O)Nc3cccc(C(C)=O)c3)CC2)cc1
InChIInChI=1S/C22H25N3O4/c1-15(26)17-4-3-5-19(14-17)24-22(28)25-12-10-18(11-13-25)23-21(27)16-6-8-20(29-2)9-7-16/h3-9,14,18H,10-13H2,1-2H3,(H,23,27)(H,24,28)
InChIKeyFKSPMDXRLLWPID-UHFFFAOYSA-N
MW395.46 g/mol
LogP3.32
Rot. Bonds5

About N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide

N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide (PubChem CID 43814135) has the molecular formula C22H25N3O4 and a molecular weight of 395.46 g/mol. Its IUPAC name is N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
PubChem CID43814135
Molecular FormulaC22H25N3O4
Molecular Weight395.46 g/mol
Exact Mass395.18
IUPAC NameN-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
SMILESCOc1ccc(C(=O)NC2CCN(C(=O)Nc3cccc(C(C)=O)c3)CC2)cc1
InChIInChI=1S/C22H25N3O4/c1-15(26)17-4-3-5-19(14-17)24-22(28)25-12-10-18(11-13-25)23-21(27)16-6-8-20(29-2)9-7-16/h3-9,14,18H,10-13H2,1-2H3,(H,23,27)(H,24,28)
InChIKeyFKSPMDXRLLWPID-UHFFFAOYSA-N
XLogP3.32
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide
CID 108548929
N-(4-methoxyphenyl)-4-[(3-methylbenzoyl)amino]piperidine-1-carboxamide
CID 43814085
4-[(3-methoxybenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 43814029
4-benzamido-N-(3-methylphenyl)piperidine-1-carboxamide
CID 43814049
N-(2-fluorophenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
CID 3218434
N-(3-acetylphenyl)-4-(cyclohexanecarbonylamino)piperidine-1-carboxamide
CID 24792518
4-methoxy-N-[1-(phenylcarbamothioyl)piperidin-4-yl]benzamide
CID 3218579
N-(3-acetylphenyl)-4-(3,5-dimethoxybenzoyl)piperazine-1-carboxamide
CID 55696947
N-(3-acetylphenyl)-4-(4-methoxyphenoxy)benzamide
CID 16651157
N-benzyl-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
CID 24793478
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-fluorobenzamide
CID 32508951
3-acetamido-N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]benzamide
CID 108553820

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide (CID 43814135) is N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide is COc1ccc(C(=O)NC2CCN(C(=O)Nc3cccc(C(C)=O)c3)CC2)cc1.
What is the InChIKey of N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
The InChIKey is FKSPMDXRLLWPID-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O4/c1-15(26)17-4-3-5-19(14-17)24-22(28)25-12-10-18(11-13-25)23-21(27)16-6-8-20(29-2)9-7-16/h3-9,14,18H,10-13H2,1-2H3,(H,23,27)(H,24,28).
What are the key properties of N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide?
N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide has a molecular weight of 395.46 g/mol, XLogP of 3.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 43814135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).