N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide

C18H23N3O — CID 84600217

IUPACN-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide
SMILESCC(=O)NC1CCCN(c2c(C)c(C)nc3ccccc23)C1
InChIInChI=1S/C18H23N3O/c1-12-13(2)19-17-9-5-4-8-16(17)18(12)21-10-6-7-15(11-21)20-14(3)22/h4-5,8-9,15H,6-7,10-11H2,1-3H3,(H,20,22)
InChIKeyGSWVOWDTIOWZTL-UHFFFAOYSA-N
MW297.40 g/mol
LogP2.96
Rot. Bonds2

About N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide

N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide (PubChem CID 84600217) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide
PubChem CID84600217
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC NameN-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide
SMILESCC(=O)NC1CCCN(c2c(C)c(C)nc3ccccc23)C1
InChIInChI=1S/C18H23N3O/c1-12-13(2)19-17-9-5-4-8-16(17)18(12)21-10-6-7-15(11-21)20-14(3)22/h4-5,8-9,15H,6-7,10-11H2,1-3H3,(H,20,22)
InChIKeyGSWVOWDTIOWZTL-UHFFFAOYSA-N
XLogP2.96
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-cyano-4-methylquinolin-2-yl)piperidin-3-yl]acetamide
CID 146038812
N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124519191
4-[[(3R)-1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]methyl]morpholine
CID 154755885
N-[1-(4-methylquinolin-2-yl)piperidin-3-yl]cyclopropanecarboxamide
CID 155974621
N-[1-(6-bromo-5,7-dimethyl-1,8-naphthyridin-2-yl)piperidin-3-yl]acetamide
CID 171335810
methyl (3R)-1-(3-ethyl-2-methylquinolin-4-yl)piperidine-3-carboxylate
CID 133438071
N-[1-(4-methyl-1,3-thiazol-2-yl)piperidin-3-yl]acetamide
CID 171335280
N-[1-(6-methylpyrazin-2-yl)piperidin-3-yl]acetamide
CID 171327953
[(3R)-1-phenylpiperidin-3-yl]carbamic acid
CID 89499357
N-[1-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperidin-3-yl]acetamide
CID 171328526
N-[1-[2-amino-5-(6-amino-3-pyridinyl)-6-methylpyrimidin-4-yl]piperidin-3-yl]acetamide
CID 70671781
N-[1-(2-amino-6-ethyl-5-methylpyrimidin-4-yl)piperidin-3-yl]acetamide
CID 137339870

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide?
The IUPAC name of N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide (CID 84600217) is N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide.
What is the SMILES notation for N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide?
The canonical SMILES for N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide is CC(=O)NC1CCCN(c2c(C)c(C)nc3ccccc23)C1.
What is the InChIKey of N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide?
The InChIKey is GSWVOWDTIOWZTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-12-13(2)19-17-9-5-4-8-16(17)18(12)21-10-6-7-15(11-21)20-14(3)22/h4-5,8-9,15H,6-7,10-11H2,1-3H3,(H,20,22).
What are the key properties of N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide?
N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide has a molecular weight of 297.40 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,3-dimethylquinolin-4-yl)piperidin-3-yl]acetamide is sourced from PubChem (CID 84600217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).