2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide

C13H20N4O — CID 119918337

IUPAC2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide
SMILESCNC1CCCN(CC(=O)Nc2ccncc2)C1
InChIInChI=1S/C13H20N4O/c1-14-12-3-2-8-17(9-12)10-13(18)16-11-4-6-15-7-5-11/h4-7,12,14H,2-3,8-10H2,1H3,(H,15,16,18)
InChIKeyUDMUCHLXJUXRPQ-UHFFFAOYSA-N
MW248.33 g/mol
LogP0.70
Rot. Bonds4

About 2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide

2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide (PubChem CID 119918337) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide.

Molecular Properties

Compound Name2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide
PubChem CID119918337
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide
SMILESCNC1CCCN(CC(=O)Nc2ccncc2)C1
InChIInChI=1S/C13H20N4O/c1-14-12-3-2-8-17(9-12)10-13(18)16-11-4-6-15-7-5-11/h4-7,12,14H,2-3,8-10H2,1H3,(H,15,16,18)
InChIKeyUDMUCHLXJUXRPQ-UHFFFAOYSA-N
XLogP0.70
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide;dihydrochloride
CID 119918336
2-(3-methylpiperidin-1-yl)-N-pyridin-4-ylacetamide
CID 17066608
N-(3,4-dichlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62545984
N-(3-iodophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919334
N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62545829
N-(3,4-dimethoxyphenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 119920227
2-[3-(methylamino)piperidin-1-yl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 119919788
N-(4-chlorophenyl)-2-[3-(methylamino)pyrrolidin-1-yl]acetamide
CID 81493727
2-[3-(methylamino)piperidin-1-yl]-N-(2-methyl-1,3-dioxoisoindol-5-yl)acetamide;hydrochloride
CID 119919466
2-(3-acetamidopiperidin-1-yl)-N-phenylacetamide
CID 60503649
2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide
CID 60511665
2-[3-(methylamino)piperidin-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119920212

Frequently Asked Questions

What is the IUPAC name of 2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide?
The IUPAC name of 2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide (CID 119918337) is 2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide.
What is the SMILES notation for 2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide?
The canonical SMILES for 2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide is CNC1CCCN(CC(=O)Nc2ccncc2)C1.
What is the InChIKey of 2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide?
The InChIKey is UDMUCHLXJUXRPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-14-12-3-2-8-17(9-12)10-13(18)16-11-4-6-15-7-5-11/h4-7,12,14H,2-3,8-10H2,1H3,(H,15,16,18).
What are the key properties of 2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide?
2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide has a molecular weight of 248.33 g/mol, XLogP of 0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide is sourced from PubChem (CID 119918337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).