2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide

C15H20N4O — CID 79327658

IUPAC2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide
SMILESCc1ccc(C#N)cc1NC(=O)CN1CCC(N)CC1
InChIInChI=1S/C15H20N4O/c1-11-2-3-12(9-16)8-14(11)18-15(20)10-19-6-4-13(17)5-7-19/h2-3,8,13H,4-7,10,17H2,1H3,(H,18,20)
InChIKeyRUOPDYQVOKVSML-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.23
Rot. Bonds3

About 2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide

2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide (PubChem CID 79327658) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide
PubChem CID79327658
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide
SMILESCc1ccc(C#N)cc1NC(=O)CN1CCC(N)CC1
InChIInChI=1S/C15H20N4O/c1-11-2-3-12(9-16)8-14(11)18-15(20)10-19-6-4-13(17)5-7-19/h2-3,8,13H,4-7,10,17H2,1H3,(H,18,20)
InChIKeyRUOPDYQVOKVSML-UHFFFAOYSA-N
XLogP1.23
TPSA82.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminopiperidin-1-yl)-N-(4-cyano-2-methoxyphenyl)acetamide
CID 104848882
2-(3-aminopyrrolidin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 62068769
N-(2,5-dimethylphenyl)-2-(4-fluoropiperidin-1-yl)acetamide
CID 171701345
2-(4-aminopiperidin-1-yl)-N-(3-hydroxy-2,4-dimethylphenyl)acetamide
CID 79327471
4-[[2-(4-aminopiperidin-1-yl)acetyl]amino]-3-methylbenzamide
CID 79322701
N-[5-cyano-2-(propylamino)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide
CID 75425610
5-[[2-(4-aminopiperidin-1-yl)acetyl]amino]-2-methylbenzoic acid
CID 79323581
N-(5-cyano-2-methylphenyl)-2-(3-methyl-2-oxobenzimidazol-1-yl)acetamide
CID 86867968
2-(1-aminocyclopentyl)-N-(5-cyano-2-methylphenyl)acetamide
CID 64679673
2-(4-amino-3-methylpiperidin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 79868364
4-[(4-aminopiperidin-1-yl)methyl]-3-methylbenzonitrile
CID 114484783
N-(4-cyanophenyl)-2-[4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 43246133

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide (CID 79327658) is 2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide is Cc1ccc(C#N)cc1NC(=O)CN1CCC(N)CC1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide?
The InChIKey is RUOPDYQVOKVSML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-11-2-3-12(9-16)8-14(11)18-15(20)10-19-6-4-13(17)5-7-19/h2-3,8,13H,4-7,10,17H2,1H3,(H,18,20).
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide?
2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide has a molecular weight of 272.35 g/mol, XLogP of 1.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-(5-cyano-2-methylphenyl)acetamide is sourced from PubChem (CID 79327658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).