2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide

C14H21N3O — CID 108999232

IUPAC2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
SMILESCC1CCCN(CC(=O)NCc2ccccn2)C1
InChIInChI=1S/C14H21N3O/c1-12-5-4-8-17(10-12)11-14(18)16-9-13-6-2-3-7-15-13/h2-3,6-7,12H,4-5,8-11H2,1H3,(H,16,18)
InChIKeyKATPCILTTVXATB-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.43
Rot. Bonds4

About 2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide

2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 108999232) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
PubChem CID108999232
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
SMILESCC1CCCN(CC(=O)NCc2ccccn2)C1
InChIInChI=1S/C14H21N3O/c1-12-5-4-8-17(10-12)11-14(18)16-9-13-6-2-3-7-15-13/h2-3,6-7,12H,4-5,8-11H2,1H3,(H,16,18)
InChIKeyKATPCILTTVXATB-UHFFFAOYSA-N
XLogP1.43
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3R)-3-[[(2R)-2-methylpiperidin-1-yl]methyl]piperidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95626413
2-[(3R,4R)-3-hydroxy-3,4-dimethylpyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 72894294
2-[(3S)-3-(1-methylbenzimidazol-2-yl)piperidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 92626481
N-[(2-methylphenyl)methyl]-2-(3-methylpiperidin-1-yl)acetamide
CID 108996675
2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 79333901
2-(6-hydroxy-4-propyl-1,4-diazepan-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 74242130
2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 56803059
2-methyl-1-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-3-(pyridin-2-ylmethyl)guanidine
CID 110967468
2-[(2R)-2-phenylthiomorpholin-4-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 97214559
N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide
CID 8903458
2-[(3S)-3-[2-(dimethylamino)-5-(4-fluorophenyl)pyrimidin-4-yl]piperidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 92617482
N-(1,3-benzoxazol-2-ylmethyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 91792073

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide (CID 108999232) is 2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide is CC1CCCN(CC(=O)NCc2ccccn2)C1.
What is the InChIKey of 2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is KATPCILTTVXATB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-12-5-4-8-17(10-12)11-14(18)16-9-13-6-2-3-7-15-13/h2-3,6-7,12H,4-5,8-11H2,1H3,(H,16,18).
What are the key properties of 2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide?
2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 247.34 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 108999232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).