(2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide

C17H25N3O3 — CID 128978853

IUPAC(2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide
SMILESCOc1ccnc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)c1
InChIInChI=1S/C17H25N3O3/c1-22-14-2-6-19-13(10-14)11-20-7-3-12(4-8-20)16-15(17(18)21)5-9-23-16/h2,6,10,12,15-16H,3-5,7-9,11H2,1H3,(H2,18,21)/t15-,16+/m0/s1
InChIKeyFSZJQSWJXQFJIG-JKSUJKDBSA-N
MW319.40 g/mol
LogP1.19
Rot. Bonds5

About (2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide

(2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide (PubChem CID 128978853) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is (2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide.

Molecular Properties

Compound Name(2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide
PubChem CID128978853
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC Name(2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide
SMILESCOc1ccnc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)c1
InChIInChI=1S/C17H25N3O3/c1-22-14-2-6-19-13(10-14)11-20-7-3-12(4-8-20)16-15(17(18)21)5-9-23-16/h2,6,10,12,15-16H,3-5,7-9,11H2,1H3,(H2,18,21)/t15-,16+/m0/s1
InChIKeyFSZJQSWJXQFJIG-JKSUJKDBSA-N
XLogP1.19
TPSA77.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3S)-2-[1-[[4-(methoxymethyl)phenyl]methyl]piperidin-4-yl]oxolane-3-carboxamide
CID 154802072
(2R,3S)-2-[1-[(1-methylbenzimidazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide
CID 167949273
(2R,3S)-2-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide
CID 128978878
(2R,3S)-2-[1-[(5-cyclopropyl-1,2-oxazol-4-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide
CID 154759723
(2R,3S)-2-[1-[(5-cyanofuran-2-yl)methyl]piperidin-4-yl]oxolane-3-carboxamide
CID 154756732
(2R,3S)-2-[1-[[5-chloro-2-(dimethylamino)-1-phenylimidazol-4-yl]methyl]piperidin-4-yl]oxolane-3-carboxamide
CID 138043200
(2R,3S)-2-[1-(6-piperidin-1-ylpyrimidin-4-yl)piperidin-4-yl]oxolane-3-carboxamide
CID 128977579
N-cyclobutyl-N-[(4R)-1-[(4-methoxy-2-pyridinyl)methyl]azepan-4-yl]methanesulfonamide
CID 129341023
4-[(4-methoxy-2-pyridinyl)methyl]-1,4-thiazepane
CID 75503314
1-[(4-methoxy-2-pyridinyl)methyl]piperazine;2,2,2-trifluoroacetic acid
CID 167924639
(3R)-8-[(4-methoxy-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decane-3-carboxylic acid
CID 95873944
(3S)-N-(2-methoxyethyl)-1-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]piperidine-3-carboxamide
CID 95402453

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide?
The IUPAC name of (2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide (CID 128978853) is (2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide.
What is the SMILES notation for (2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide?
The canonical SMILES for (2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide is COc1ccnc(CN2CCC([C@H]3OCC[C@@H]3C(N)=O)CC2)c1.
What is the InChIKey of (2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide?
The InChIKey is FSZJQSWJXQFJIG-JKSUJKDBSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-22-14-2-6-19-13(10-14)11-20-7-3-12(4-8-20)16-15(17(18)21)5-9-23-16/h2,6,10,12,15-16H,3-5,7-9,11H2,1H3,(H2,18,21)/t15-,16+/m0/s1.
What are the key properties of (2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide?
(2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide has a molecular weight of 319.40 g/mol, XLogP of 1.19, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-[1-[(4-methoxy-2-pyridinyl)methyl]piperidin-4-yl]oxolane-3-carboxamide is sourced from PubChem (CID 128978853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).