2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide

C15H21N3O3 — CID 81394842

IUPAC2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide
SMILESCOc1cccc(N)c1C(=O)N1CCC(CC(N)=O)CC1
InChIInChI=1S/C15H21N3O3/c1-21-12-4-2-3-11(16)14(12)15(20)18-7-5-10(6-8-18)9-13(17)19/h2-4,10H,5-9,16H2,1H3,(H2,17,19)
InChIKeyFUCRGIVATGMWCJ-UHFFFAOYSA-N
MW291.35 g/mol
LogP1.00
Rot. Bonds4

About 2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide

2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide (PubChem CID 81394842) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide
PubChem CID81394842
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide
SMILESCOc1cccc(N)c1C(=O)N1CCC(CC(N)=O)CC1
InChIInChI=1S/C15H21N3O3/c1-21-12-4-2-3-11(16)14(12)15(20)18-7-5-10(6-8-18)9-13(17)19/h2-4,10H,5-9,16H2,1H3,(H2,17,19)
InChIKeyFUCRGIVATGMWCJ-UHFFFAOYSA-N
XLogP1.00
TPSA98.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2-amino-6-methoxyphenyl)-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methanone
CID 81395791
(2-amino-6-methoxyphenyl)-(4,4-diethylpiperidin-1-yl)methanone
CID 81394866
1-(2-amino-6-ethoxybenzoyl)piperidine-4-carboxamide
CID 81393685
2-[1-(3-hydroxy-4-methoxybenzoyl)piperidin-4-yl]acetamide
CID 79672061
(2-amino-6-methoxyphenyl)-(4-hydroxy-4-methylpiperidin-1-yl)methanone
CID 81420206
(2-amino-6-methoxyphenyl)-(4-methylsulfonylpiperazin-1-yl)methanone
CID 81395584
[4-(2-aminoethyl)piperidin-1-yl]-(2-fluoro-6-methoxyphenyl)methanone
CID 65435015
2-[1-(3-aminopyridine-2-carbonyl)piperidin-4-yl]acetamide
CID 104741733
(2-amino-6-methoxyphenyl)-(1,4-thiazepan-4-yl)methanone
CID 81420652
1-(2-amino-6-methoxybenzoyl)-N-methylpiperidine-3-carboxamide
CID 103194108
(2-amino-6-methylphenyl)-(4-ethylpiperidin-1-yl)methanone
CID 61116229
(2-amino-6-methoxyphenyl)-(3-hydroxy-3-methylazetidin-1-yl)methanone
CID 107210563

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide (CID 81394842) is 2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide is COc1cccc(N)c1C(=O)N1CCC(CC(N)=O)CC1.
What is the InChIKey of 2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide?
The InChIKey is FUCRGIVATGMWCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-21-12-4-2-3-11(16)14(12)15(20)18-7-5-10(6-8-18)9-13(17)19/h2-4,10H,5-9,16H2,1H3,(H2,17,19).
What are the key properties of 2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide?
2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide has a molecular weight of 291.35 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-amino-6-methoxybenzoyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 81394842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).