2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide

C15H23N3O — CID 83012801

IUPAC2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide
SMILESCC1CCCC(C)N1NC(=O)Cc1ccccc1N
InChIInChI=1S/C15H23N3O/c1-11-6-5-7-12(2)18(11)17-15(19)10-13-8-3-4-9-14(13)16/h3-4,8-9,11-12H,5-7,10,16H2,1-2H3,(H,17,19)
InChIKeyQNDOYQWJEGDNAA-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.11
Rot. Bonds3

About 2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide

2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide (PubChem CID 83012801) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide
PubChem CID83012801
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide
SMILESCC1CCCC(C)N1NC(=O)Cc1ccccc1N
InChIInChI=1S/C15H23N3O/c1-11-6-5-7-12(2)18(11)17-15(19)10-13-8-3-4-9-14(13)16/h3-4,8-9,11-12H,5-7,10,16H2,1-2H3,(H,17,19)
InChIKeyQNDOYQWJEGDNAA-UHFFFAOYSA-N
XLogP2.11
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)methanesulfonamide
CID 83013302
2-(2-aminophenyl)-N-methylacetamide
CID 16772909
2-(2-aminophenyl)-1-(3,4-dimethylpyrrolidin-1-yl)ethanone
CID 79189038
2-(2-aminophenyl)-N-(cyclopropylmethyl)acetamide
CID 16791289
2-(2-aminophenyl)-N-(2,2-dimethylcyclohexyl)acetamide
CID 79855624
2-[4-(aminomethyl)cyclohexyl]-N-(2,6-dimethylpiperidin-1-yl)acetamide
CID 83024120
2-(2-aminophenyl)-N-(3-hydroxy-2,2-dimethylcyclobutyl)acetamide
CID 114628289
2-(2-aminophenyl)-N-[(4-hydroxycyclohexyl)methyl]acetamide
CID 106119007
2-(2-aminophenyl)-N-(thian-4-yl)acetamide
CID 115753416
2-[3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]propyl]aniline
CID 107274621
N-(2,6-dimethylpiperidin-1-yl)-2-(ethylamino)acetamide
CID 83020995
N-(2,6-dimethylpiperidin-1-yl)-2-methoxyacetamide
CID 70906561

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide (CID 83012801) is 2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide is CC1CCCC(C)N1NC(=O)Cc1ccccc1N.
What is the InChIKey of 2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide?
The InChIKey is QNDOYQWJEGDNAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-6-5-7-12(2)18(11)17-15(19)10-13-8-3-4-9-14(13)16/h3-4,8-9,11-12H,5-7,10,16H2,1-2H3,(H,17,19).
What are the key properties of 2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide?
2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide has a molecular weight of 261.37 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-(2,6-dimethylpiperidin-1-yl)acetamide is sourced from PubChem (CID 83012801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).