N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide

C16H19N5O2 — CID 95273055

IUPACN-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide
SMILESCNC(=O)c1ccc(C(=O)N2CCC[C@@H](n3cccn3)C2)cn1
InChIInChI=1S/C16H19N5O2/c1-17-15(22)14-6-5-12(10-18-14)16(23)20-8-2-4-13(11-20)21-9-3-7-19-21/h3,5-7,9-10,13H,2,4,8,11H2,1H3,(H,17,22)/t13-/m1/s1
InChIKeyPQPDGPCFIOBQJN-CYBMUJFWSA-N
MW313.36 g/mol
LogP1.12
Rot. Bonds3

About N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide

N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide (PubChem CID 95273055) has the molecular formula C16H19N5O2 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide
PubChem CID95273055
Molecular FormulaC16H19N5O2
Molecular Weight313.36 g/mol
Exact Mass313.15
IUPAC NameN-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide
SMILESCNC(=O)c1ccc(C(=O)N2CCC[C@@H](n3cccn3)C2)cn1
InChIInChI=1S/C16H19N5O2/c1-17-15(22)14-6-5-12(10-18-14)16(23)20-8-2-4-13(11-20)21-9-3-7-19-21/h3,5-7,9-10,13H,2,4,8,11H2,1H3,(H,17,22)/t13-/m1/s1
InChIKeyPQPDGPCFIOBQJN-CYBMUJFWSA-N
XLogP1.12
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4-aminophenyl)-(3-pyrazol-1-ylpiperidin-1-yl)methanone
CID 110474500
(4-methylsulfonylphenyl)-[(3R)-3-pyrazol-1-ylpiperidin-1-yl]methanone
CID 95158589
[4-(pyrazol-1-ylmethyl)phenyl]-[(3R)-3-pyrazol-1-ylpiperidin-1-yl]methanone
CID 95277241
3-[1-[6-(methylcarbamoyl)pyridine-3-carbonyl]piperidin-3-yl]propanoic acid
CID 120536442
[(3S)-3-pyrazol-1-ylpiperidin-1-yl]-[4-(1,2,4-triazol-4-yl)phenyl]methanone
CID 95282730
N-methyl-5-(3-piperazin-1-ylpyrrolidine-1-carbonyl)pyridine-2-carboxamide;hydrochloride
CID 120996292
[(3R)-3-pyrazol-1-ylpiperidin-1-yl]-thiophen-3-ylmethanone
CID 95383030
(3-methyl-[1,2]thiazolo[5,4-b]pyridin-5-yl)-[(3R)-3-pyrazol-1-ylpiperidin-1-yl]methanone
CID 95160978
(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)-[(3S)-3-pyrazol-1-ylpiperidin-1-yl]methanone
CID 95768735
5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]-1,3-dihydrobenzimidazol-2-one
CID 95282709
1,3-benzodioxol-5-yl-[(3R)-3-pyrazol-1-ylpiperidin-1-yl]methanone
CID 95158283
(2-methyl-1,3-thiazol-5-yl)-[(3S)-3-pyrazol-1-ylpiperidin-1-yl]methanone
CID 129369690

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide?
The IUPAC name of N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide (CID 95273055) is N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide.
What is the SMILES notation for N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide?
The canonical SMILES for N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide is CNC(=O)c1ccc(C(=O)N2CCC[C@@H](n3cccn3)C2)cn1.
What is the InChIKey of N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide?
The InChIKey is PQPDGPCFIOBQJN-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H19N5O2/c1-17-15(22)14-6-5-12(10-18-14)16(23)20-8-2-4-13(11-20)21-9-3-7-19-21/h3,5-7,9-10,13H,2,4,8,11H2,1H3,(H,17,22)/t13-/m1/s1.
What are the key properties of N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide?
N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide has a molecular weight of 313.36 g/mol, XLogP of 1.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[(3R)-3-pyrazol-1-ylpiperidine-1-carbonyl]pyridine-2-carboxamide is sourced from PubChem (CID 95273055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).