1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one

C16H24N4O — CID 56781047

IUPAC1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one
SMILESCN1CCN(C2CCN(CCc3ccccn3)CC2)C1=O
InChIInChI=1S/C16H24N4O/c1-18-12-13-20(16(18)21)15-6-10-19(11-7-15)9-5-14-4-2-3-8-17-14/h2-4,8,15H,5-7,9-13H2,1H3
InChIKeyVIPSXVGAYQWONA-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.46
Rot. Bonds4

About 1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one

1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one (PubChem CID 56781047) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is 1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one
PubChem CID56781047
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC Name1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one
SMILESCN1CCN(C2CCN(CCc3ccccn3)CC2)C1=O
InChIInChI=1S/C16H24N4O/c1-18-12-13-20(16(18)21)15-6-10-19(11-7-15)9-5-14-4-2-3-8-17-14/h2-4,8,15H,5-7,9-13H2,1H3
InChIKeyVIPSXVGAYQWONA-UHFFFAOYSA-N
XLogP1.46
TPSA39.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-piperidin-4-yl-3-(2-pyridin-2-ylethyl)imidazolidin-2-one
CID 66000463
(8aR)-2-methyl-7-(pyridin-2-ylmethyl)-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazin-3-one
CID 75537104
(4aR)-3-(2-pyridin-2-ylethyl)-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline
CID 125482012
methyl 1-(2-pyridin-2-ylethyl)piperidine-4-carboxylate
CID 60648150
N-benzyl-N-methyl-1-(2-pyridin-2-ylethyl)piperidin-4-amine
CID 171910751
N-methyl-N-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]but-2-ynamide
CID 146091210
2-[2-[4-(phenoxymethyl)piperidin-1-yl]ethyl]pyridine
CID 146123829
1-[2-[methyl-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]amino]ethyl]pyrrolidin-2-one
CID 96567368
4-amino-N-methyl-N-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]butanamide
CID 119868618
4-methyl-1-(2-pyridin-2-ylethyl)piperidin-4-ol
CID 80702351
(4R)-2-cyclopropyl-4-phenyl-9-(2-pyridin-2-ylethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 97135359
N,4-dimethyl-N-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]benzenesulfonamide
CID 47090107

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one (CID 56781047) is 1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one is CN1CCN(C2CCN(CCc3ccccn3)CC2)C1=O.
What is the InChIKey of 1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one?
The InChIKey is VIPSXVGAYQWONA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-18-12-13-20(16(18)21)15-6-10-19(11-7-15)9-5-14-4-2-3-8-17-14/h2-4,8,15H,5-7,9-13H2,1H3.
What are the key properties of 1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one?
1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one has a molecular weight of 288.39 g/mol, XLogP of 1.46, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 56781047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).