2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile

C19H25N3O2 — CID 126873514

IUPAC2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile
SMILESN#Cc1cccnc1OCC1CCN(C(=O)CC2CCCC2)CC1
InChIInChI=1S/C19H25N3O2/c20-13-17-6-3-9-21-19(17)24-14-16-7-10-22(11-8-16)18(23)12-15-4-1-2-5-15/h3,6,9,15-16H,1-2,4-5,7-8,10-12,14H2
InChIKeyNFPOLZIBXGSMDV-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.15
Rot. Bonds5

About 2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile

2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile (PubChem CID 126873514) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile
PubChem CID126873514
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile
SMILESN#Cc1cccnc1OCC1CCN(C(=O)CC2CCCC2)CC1
InChIInChI=1S/C19H25N3O2/c20-13-17-6-3-9-21-19(17)24-14-16-7-10-22(11-8-16)18(23)12-15-4-1-2-5-15/h3,6,9,15-16H,1-2,4-5,7-8,10-12,14H2
InChIKeyNFPOLZIBXGSMDV-UHFFFAOYSA-N
XLogP3.15
TPSA66.22 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[1-(cyclopentylmethyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile
CID 126873922
2-[[1-(1-methyl-6-oxopyridazine-3-carbonyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile
CID 126873510
2-cyclopentyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 78768063
2-[[1-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile
CID 126873681
2-[1-[4-(2-cyclopentylacetyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]oxybenzonitrile
CID 55939522
tert-butyl (2S)-2-[(3-cyano-2-pyridinyl)oxymethyl]piperidine-1-carboxylate
CID 97173574
1-(4-benzylpiperidin-1-yl)-2-cyclopentylethanone
CID 127122886
2-[(2-oxopiperidin-4-yl)methoxy]pyridine-3-carbonitrile
CID 117096458
2-[[1-[(5-methyl-1,2-oxazol-4-yl)methyl]piperidin-4-yl]methoxy]pyridine-3-carbonitrile
CID 126873654
2-cyclopentyl-1-[4-(methoxymethyl)piperidin-1-yl]ethanone
CID 121091445
cyclopropyl-[4-[(3-methyl-2-pyridinyl)oxymethyl]piperidin-1-yl]methanone
CID 126872697
2-cyclopropyl-1-[4-[(3-methyl-4-pyridinyl)oxymethyl]piperidin-1-yl]ethanone
CID 155800227

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile?
The IUPAC name of 2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile (CID 126873514) is 2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile.
What is the SMILES notation for 2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile?
The canonical SMILES for 2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile is N#Cc1cccnc1OCC1CCN(C(=O)CC2CCCC2)CC1.
What is the InChIKey of 2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile?
The InChIKey is NFPOLZIBXGSMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c20-13-17-6-3-9-21-19(17)24-14-16-7-10-22(11-8-16)18(23)12-15-4-1-2-5-15/h3,6,9,15-16H,1-2,4-5,7-8,10-12,14H2.
What are the key properties of 2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile?
2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile has a molecular weight of 327.43 g/mol, XLogP of 3.15, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(2-cyclopentylacetyl)piperidin-4-yl]methoxy]pyridine-3-carbonitrile is sourced from PubChem (CID 126873514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).