N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide

C16H23N3O2 — CID 649988

IUPACN-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide
SMILESO=C(NCC1CCCO1)c1ccc(N2CCCCC2)nc1
InChIInChI=1S/C16H23N3O2/c20-16(18-12-14-5-4-10-21-14)13-6-7-15(17-11-13)19-8-2-1-3-9-19/h6-7,11,14H,1-5,8-10,12H2,(H,18,20)
InChIKeyMYEWKQVCVGOBNT-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.98
Rot. Bonds4

About N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide

N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide (PubChem CID 649988) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide
PubChem CID649988
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide
SMILESO=C(NCC1CCCO1)c1ccc(N2CCCCC2)nc1
InChIInChI=1S/C16H23N3O2/c20-16(18-12-14-5-4-10-21-14)13-6-7-15(17-11-13)19-8-2-1-3-9-19/h6-7,11,14H,1-5,8-10,12H2,(H,18,20)
InChIKeyMYEWKQVCVGOBNT-UHFFFAOYSA-N
XLogP1.98
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Pyridinecarboxamide, 2-(4-morpholinyl)-N-phenyl-
CID 714698
2-Imino-5-oxo-1-(3-pyridinylmethyl)-N-(tetrahydro-2-furanylmethyl)-1,5-dihydro-2H-dipyrido(1,2-A:2,3-D)pyrimidine-3-carboxamide
CID 646508
2-Imino-10-methyl-5-oxo-1-(3-pyridinylmethyl)-N-(tetrahydro-2-furanylmet hyl)-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidine-3-carboxamide
CID 652081
N-methyl-N-[(3S)-1-[6-(2-methylbutan-2-ylamino)pyridine-3-carbonyl]pyrrolidin-3-yl]acetamide
CID 146637370
(2S)-N-[(3S)-1-[6-(tert-butylamino)pyridine-3-carbonyl]pyrrolidin-3-yl]-N-methyloxolane-2-carboxamide
CID 146637371
3-[(3S)-1-[6-(tert-butylamino)pyridine-3-carbonyl]pyrrolidin-3-yl]-1,3-oxazolidin-2-one
CID 146637372
N-ethyl-2-(4-methylpiperazin-1-yl)pyridine-3-carboxamide
CID 3040782
N-2-Pyridinyl-3-pyridinecarboxamide
CID 83187
2-Imino-8-methyl-10-oxo-1-(tetrahydro-furan-2-ylmethyl)-1,10-dihydro-2H-1,9,10a-triaza-anthracene-3-carboxylic acid (pyridin-3-ylmethyl)-amide
CID 3151315
2-(Piperazin-1-yl)pyridine-3-carboxamide
CID 16785637
6-Morpholinonicotinamide
CID 260349
1-(5-Carbamoylpyridin-2-yl)piperidin-4-yl 4-isopropylpiperazine-1-carboxylate
CID 71533679

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide (CID 649988) is N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide is O=C(NCC1CCCO1)c1ccc(N2CCCCC2)nc1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide?
The InChIKey is MYEWKQVCVGOBNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c20-16(18-12-14-5-4-10-21-14)13-6-7-15(17-11-13)19-8-2-1-3-9-19/h6-7,11,14H,1-5,8-10,12H2,(H,18,20).
What are the key properties of N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide?
N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-6-piperidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 649988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).