oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone

C14H19N3O2 — CID 2970509

IUPACoxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
SMILESO=C(C1CCCO1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C14H19N3O2/c18-14(12-4-3-11-19-12)17-9-7-16(8-10-17)13-5-1-2-6-15-13/h1-2,5-6,12H,3-4,7-11H2
InChIKeyIGEAOEFDPIDREO-UHFFFAOYSA-N
MW261.32 g/mol
LogP0.91
Rot. Bonds2

About oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone

oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone (PubChem CID 2970509) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone.

Molecular Properties

Compound Nameoxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
PubChem CID2970509
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Nameoxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
SMILESO=C(C1CCCO1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C14H19N3O2/c18-14(12-4-3-11-19-12)17-9-7-16(8-10-17)13-5-1-2-6-15-13/h1-2,5-6,12H,3-4,7-11H2
InChIKeyIGEAOEFDPIDREO-UHFFFAOYSA-N
XLogP0.91
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Pentanedioic acid cyclohexylcarbamoylmethyl-(tetrahydro-furan-2-ylmethyl)-amide pyridin-2-ylamide
CID 645755
N-Pyridin-2-yl-N'-(tetrahydro-furan-2-ylmethyl)-N'-{[(tetrahydro-furan-2-ylmethyl)-carbamoyl]-methyl}-succinamide
CID 651646
N-[(2-Methoxy-ethylcarbamoyl)-methyl]-N'-pyridin-2-yl-N-(tetrahydro-furan-2-ylmethyl)-succinamide
CID 645482
Morpholin-4-yl 4-(2-pyridyl)piperazinyl ketone
CID 752010
N'-(2-methoxyethyl)-N'-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]-N-pyridin-2-ylbutanediamide
CID 3204891
2-methoxy-1-[(5S)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]ethanone
CID 3234861
1-(4-(2-Pyridyl)piperazinyl)pentan-1-one
CID 17217518
Propanamide, N-(1-methyl-2-(4-morpholinyl)ethyl)-N-2-pyridinyl-
CID 3041498
4H-Pyrido(2,3-b)(1,4)diazepin-4-one, 3,5-dihydro-2-methyl-5-(2-(4-morpholinyl)ethyl)-, monohydrochloride
CID 3087183
N-(4-methylpyridin-2-yl)oxolane-2-carboxamide
CID 4342590
3-(4-Pyridin-2-ylpiperazin-1-yl)oxolan-2-one
CID 17501521
2-cyclopentyloxy-N-[2-(dimethylamino)-3-pyridinyl]acetamide
CID 47243303

Frequently Asked Questions

What is the IUPAC name of oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone?
The IUPAC name of oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone (CID 2970509) is oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone.
What is the SMILES notation for oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone?
The canonical SMILES for oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone is O=C(C1CCCO1)N1CCN(c2ccccn2)CC1.
What is the InChIKey of oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone?
The InChIKey is IGEAOEFDPIDREO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c18-14(12-4-3-11-19-12)17-9-7-16(8-10-17)13-5-1-2-6-15-13/h1-2,5-6,12H,3-4,7-11H2.
What are the key properties of oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone?
oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone has a molecular weight of 261.32 g/mol, XLogP of 0.91, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone is sourced from PubChem (CID 2970509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).