N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide

C18H27N5O — CID 125156899

IUPACN-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
SMILESCC(C)CN1CCCC[C@@H]1CCNC(=O)c1cccn2cnnc12
InChIInChI=1S/C18H27N5O/c1-14(2)12-22-10-4-3-6-15(22)8-9-19-18(24)16-7-5-11-23-13-20-21-17(16)23/h5,7,11,13-15H,3-4,6,8-10,12H2,1-2H3,(H,19,24)/t15-/m1/s1
InChIKeyLHWNUFUUANUXFX-OAHLLOKOSA-N
MW329.45 g/mol
LogP2.36
Rot. Bonds6

About N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide

N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide (PubChem CID 125156899) has the molecular formula C18H27N5O and a molecular weight of 329.45 g/mol. Its IUPAC name is N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
PubChem CID125156899
Molecular FormulaC18H27N5O
Molecular Weight329.45 g/mol
Exact Mass329.22
IUPAC NameN-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
SMILESCC(C)CN1CCCC[C@@H]1CCNC(=O)c1cccn2cnnc12
InChIInChI=1S/C18H27N5O/c1-14(2)12-22-10-4-3-6-15(22)8-9-19-18(24)16-7-5-11-23-13-20-21-17(16)23/h5,7,11,13-15H,3-4,6,8-10,12H2,1-2H3,(H,19,24)/t15-/m1/s1
InChIKeyLHWNUFUUANUXFX-OAHLLOKOSA-N
XLogP2.36
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide with MolForge

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Related Compounds

3,5-dimethyl-N-[2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]ethyl]imidazole-4-carboxamide
CID 125177821
N-[2-[(2S)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-2-(triazol-1-yl)acetamide
CID 126437543
N-[[1-(2-hydroxyethyl)piperidin-3-yl]methyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 118795747
N-[[4-(cyclopentylmethoxy)phenyl]methyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 146264092
2-[1-(2-methylpropyl)piperidin-2-yl]ethanol
CID 62021194
2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]benzamide
CID 70845742
2-[(2S)-1-amino-1-oxopropan-2-yl]sulfanyl-N-[[(2R)-1-ethylpiperidin-2-yl]methyl]benzamide
CID 124730047
1-methyl-3-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-1-(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)urea
CID 126449363
N-[(3S,7S,8aS)-3-cyclopropyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-7-yl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide
CID 154817380
N-[2-[(2R)-1-benzylpiperidin-2-yl]ethyl]-1H-imidazole-5-carboxamide
CID 125158764
1-[1-(2-methylpropyl)piperidin-2-yl]propan-2-one
CID 79537849
N-(2-methoxyethyl)-3-[[1-(2-methylpropyl)piperidin-2-yl]methyl]-1-benzothiophene-2-carboxamide
CID 110259945

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide?
The IUPAC name of N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide (CID 125156899) is N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide.
What is the SMILES notation for N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide?
The canonical SMILES for N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide is CC(C)CN1CCCC[C@@H]1CCNC(=O)c1cccn2cnnc12.
What is the InChIKey of N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide?
The InChIKey is LHWNUFUUANUXFX-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H27N5O/c1-14(2)12-22-10-4-3-6-15(22)8-9-19-18(24)16-7-5-11-23-13-20-21-17(16)23/h5,7,11,13-15H,3-4,6,8-10,12H2,1-2H3,(H,19,24)/t15-/m1/s1.
What are the key properties of N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide?
N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide has a molecular weight of 329.45 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2R)-1-(2-methylpropyl)piperidin-2-yl]ethyl]-[1,2,4]triazolo[4,3-a]pyridine-8-carboxamide is sourced from PubChem (CID 125156899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).