2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide

C14H21N3O2 — CID 102977410

IUPAC2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CN2CCC[C@@H](N)C2)cc1
InChIInChI=1S/C14H21N3O2/c1-19-13-6-4-12(5-7-13)16-14(18)10-17-8-2-3-11(15)9-17/h4-7,11H,2-3,8-10,15H2,1H3,(H,16,18)/t11-/m1/s1
InChIKeyTYVIYSMJYXPAKT-LLVKDONJSA-N
MW263.34 g/mol
LogP1.06
Rot. Bonds4

About 2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide

2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide (PubChem CID 102977410) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide
PubChem CID102977410
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CN2CCC[C@@H](N)C2)cc1
InChIInChI=1S/C14H21N3O2/c1-19-13-6-4-12(5-7-13)16-14(18)10-17-8-2-3-11(15)9-17/h4-7,11H,2-3,8-10,15H2,1H3,(H,16,18)/t11-/m1/s1
InChIKeyTYVIYSMJYXPAKT-LLVKDONJSA-N
XLogP1.06
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-aminopiperidin-1-yl)-N-(4-methylphenyl)acetamide
CID 61297774
1-[2-(4-methoxyanilino)-2-oxoethyl]piperidine-3-carboxylic acid
CID 43440705
2-[(3R)-3-aminopiperidin-1-yl]-N-(4-fluorophenyl)acetamide
CID 102977214
2-(3-aminopiperidin-1-yl)-N-(4-fluorophenyl)acetamide
CID 61297951
2-(3-aminopiperidin-1-yl)-N-(3,4-dimethylphenyl)acetamide
CID 61298131
2-(3,4-dihydroxypyrrolidin-1-yl)-N-(4-methoxyphenyl)acetamide
CID 106671846
2-[4-(hydroxymethyl)piperidin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 47284409
2-(4-hydroxypiperidin-1-yl)-N-(4-methoxyphenyl)acetamide
CID 51171901
N-(4-ethoxyphenyl)-2-[3-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60642593
2-(3-aminopiperidin-1-yl)-N-(3-propan-2-ylphenyl)acetamide
CID 61295961
2-[3-(aminomethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide;hydrochloride
CID 119915580
2-(3-aminopiperidin-1-yl)-N-(3-iodophenyl)acetamide;hydrochloride
CID 119910140

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide (CID 102977410) is 2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)CN2CCC[C@@H](N)C2)cc1.
What is the InChIKey of 2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide?
The InChIKey is TYVIYSMJYXPAKT-LLVKDONJSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-19-13-6-4-12(5-7-13)16-14(18)10-17-8-2-3-11(15)9-17/h4-7,11H,2-3,8-10,15H2,1H3,(H,16,18)/t11-/m1/s1.
What are the key properties of 2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide?
2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide has a molecular weight of 263.34 g/mol, XLogP of 1.06, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-aminopiperidin-1-yl]-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 102977410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).