(3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide

C16H21N5O3 — CID 126453895

IUPAC(3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide
SMILESCc1nnc(CNC(=O)N2CCC[C@@H](OCc3ccccn3)C2)o1
InChIInChI=1S/C16H21N5O3/c1-12-19-20-15(24-12)9-18-16(22)21-8-4-6-14(10-21)23-11-13-5-2-3-7-17-13/h2-3,5,7,14H,4,6,8-11H2,1H3,(H,18,22)/t14-/m1/s1
InChIKeyJKKKDNLFZSYOLE-CQSZACIVSA-N
MW331.38 g/mol
LogP1.66
Rot. Bonds5

About (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide

(3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide (PubChem CID 126453895) has the molecular formula C16H21N5O3 and a molecular weight of 331.38 g/mol. Its IUPAC name is (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide
PubChem CID126453895
Molecular FormulaC16H21N5O3
Molecular Weight331.38 g/mol
Exact Mass331.16
IUPAC Name(3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide
SMILESCc1nnc(CNC(=O)N2CCC[C@@H](OCc3ccccn3)C2)o1
InChIInChI=1S/C16H21N5O3/c1-12-19-20-15(24-12)9-18-16(22)21-8-4-6-14(10-21)23-11-13-5-2-3-7-17-13/h2-3,5,7,14H,4,6,8-11H2,1H3,(H,18,22)/t14-/m1/s1
InChIKeyJKKKDNLFZSYOLE-CQSZACIVSA-N
XLogP1.66
TPSA93.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide with MolForge

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Related Compounds

N-methyl-N-[(1-{2-oxo-2-[3-(2-pyridinylmethoxy)-1-piperidinyl]ethyl}-1H-tetrazol-5-yl)methyl]-2-propanamine
CID 45248909
N-methyl-2-oxo-2-[3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethanamine
CID 56871589
1-Methyl-3-{2-oxo-2-[4-(pyridin-2-ylmethoxy)piperidin-1-YL]ethyl}imidazolidin-2-one
CID 121509142
2-(2-oxopyrrolidin-1-yl)-N-[(3S,4S)-4-(pyridin-2-ylmethoxy)oxan-3-yl]acetamide
CID 164629731
(2S)-2-(2-methylpyrazol-3-yl)-N-(2-methyl-2-pyridin-3-ylpropyl)morpholine-4-carboxamide
CID 164642327
5-(dimethylamino)-2-{2-oxo-2-[3-(2-pyridinylmethoxy)-1-piperidinyl]ethyl}-3(2H)-pyridazinone
CID 45209170
1-[6-[3-(dimethylamino)pyrrolidin-1-yl]-2-oxo-1H-pyridin-3-yl]-4-(pyridin-2-ylmethoxy)pyridin-2-one
CID 67158533
6-isobutyl-4-{[3-(pyridin-2-ylmethoxy)piperidin-1-yl]carbonyl}pyrimidin-2(1H)-one
CID 77095156
N-[(1S)-5-amino-1-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)pentyl]acetamide
CID 138601502
N-[5-amino-1-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)pentyl]acetamide;ethane
CID 142574873
1-[5-(1-methylpyrrol-2-yl)-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl]ethanone
CID 23883998
2-[5-[[methyl(propan-2-yl)amino]methyl]tetrazol-1-yl]-1-[(3R)-3-(pyridin-2-ylmethoxy)piperidin-1-yl]ethanone
CID 26401875

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide?
The IUPAC name of (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide (CID 126453895) is (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide.
What is the SMILES notation for (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide?
The canonical SMILES for (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide is Cc1nnc(CNC(=O)N2CCC[C@@H](OCc3ccccn3)C2)o1.
What is the InChIKey of (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide?
The InChIKey is JKKKDNLFZSYOLE-CQSZACIVSA-N. The full InChI is InChI=1S/C16H21N5O3/c1-12-19-20-15(24-12)9-18-16(22)21-8-4-6-14(10-21)23-11-13-5-2-3-7-17-13/h2-3,5,7,14H,4,6,8-11H2,1H3,(H,18,22)/t14-/m1/s1.
What are the key properties of (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide?
(3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide has a molecular weight of 331.38 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-3-(pyridin-2-ylmethoxy)piperidine-1-carboxamide is sourced from PubChem (CID 126453895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).