N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide

C15H23N3O2 — CID 16784173

IUPACN-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide
SMILESCOc1ccc(N)cc1NC(=O)CN1CCC(C)CC1
InChIInChI=1S/C15H23N3O2/c1-11-5-7-18(8-6-11)10-15(19)17-13-9-12(16)3-4-14(13)20-2/h3-4,9,11H,5-8,10,16H2,1-2H3,(H,17,19)
InChIKeyDKHRONVMRHQCAR-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.95
Rot. Bonds4

About N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide

N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide (PubChem CID 16784173) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide
PubChem CID16784173
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide
SMILESCOc1ccc(N)cc1NC(=O)CN1CCC(C)CC1
InChIInChI=1S/C15H23N3O2/c1-11-5-7-18(8-6-11)10-15(19)17-13-9-12(16)3-4-14(13)20-2/h3-4,9,11H,5-8,10,16H2,1-2H3,(H,17,19)
InChIKeyDKHRONVMRHQCAR-UHFFFAOYSA-N
XLogP1.95
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.95
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

N-(5-amino-2-methoxyphenyl)-2-(3-hydroxypyrrolidin-1-yl)acetamide
CID 62918714
N-(4-amino-2-methoxyphenyl)-2-(3-methylpyrrolidin-1-yl)acetamide
CID 61223798
N-(5-amino-2-methoxyphenyl)-2-(2,6-dimethylpiperidin-1-yl)acetamide
CID 16782750
N-(4-amino-2-methoxyphenyl)-2-[4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 43246094
1-[2-(5-amino-2-methoxyanilino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 43212131
N-(4-amino-2-methoxyphenyl)-2-(4-hydroxy-4-methylpiperidin-1-yl)acetamide
CID 81098626
N-(4-amino-2-methoxyphenyl)-2-[3-(dimethylamino)pyrrolidin-1-yl]acetamide
CID 63166002
N-(5-amino-2-methoxyphenyl)-4-(3-hydroxypyrrolidin-1-yl)butanamide
CID 62917024
N-(5-amino-2-methoxyphenyl)-2-(2-cyanomorpholin-4-yl)acetamide
CID 79663165
N-(2-methoxydibenzofuran-3-yl)-2-(4-methylpiperidin-1-yl)acetamide
CID 2419747
3,4,5-trimethoxy-N-[2-[[2-(4-methylpiperidin-1-yl)acetyl]amino]phenyl]benzamide
CID 3200252
N-(5-amino-2-methoxyphenyl)-3-[cyclopropylmethyl(methyl)amino]propanamide
CID 60984755

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide?
The IUPAC name of N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide (CID 16784173) is N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide?
The canonical SMILES for N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide is COc1ccc(N)cc1NC(=O)CN1CCC(C)CC1.
What is the InChIKey of N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide?
The InChIKey is DKHRONVMRHQCAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-11-5-7-18(8-6-11)10-15(19)17-13-9-12(16)3-4-14(13)20-2/h3-4,9,11H,5-8,10,16H2,1-2H3,(H,17,19).
What are the key properties of N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide?
N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)acetamide is sourced from PubChem (CID 16784173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).