2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide

C16H21N5O — CID 125023608

IUPAC2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide
SMILESCc1cccc(N2CCC[C@@H](NC(=O)c3ccnn3C)C2)n1
InChIInChI=1S/C16H21N5O/c1-12-5-3-7-15(18-12)21-10-4-6-13(11-21)19-16(22)14-8-9-17-20(14)2/h3,5,7-9,13H,4,6,10-11H2,1-2H3,(H,19,22)/t13-/m1/s1
InChIKeyYZKLDHBJBYJHTL-CYBMUJFWSA-N
MW299.38 g/mol
LogP1.52
Rot. Bonds3

About 2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide

2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide (PubChem CID 125023608) has the molecular formula C16H21N5O and a molecular weight of 299.38 g/mol. Its IUPAC name is 2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide
PubChem CID125023608
Molecular FormulaC16H21N5O
Molecular Weight299.38 g/mol
Exact Mass299.17
IUPAC Name2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide
SMILESCc1cccc(N2CCC[C@@H](NC(=O)c3ccnn3C)C2)n1
InChIInChI=1S/C16H21N5O/c1-12-5-3-7-15(18-12)21-10-4-6-13(11-21)19-16(22)14-8-9-17-20(14)2/h3,5,7-9,13H,4,6,10-11H2,1-2H3,(H,19,22)/t13-/m1/s1
InChIKeyYZKLDHBJBYJHTL-CYBMUJFWSA-N
XLogP1.52
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-3-carboxamide
CID 124573399
N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124519191
N-[1-(5,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-2-methylpyrazole-3-carboxamide
CID 172891341
tert-butyl N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]carbamate
CID 133482310
2-methyl-N-[1-[4-(trifluoromethyl)-1,3-benzothiazol-2-yl]piperidin-3-yl]pyrazole-3-carboxamide
CID 172892664
N-[1-(5-chloro-3-fluoro-2-pyridinyl)piperidin-3-yl]-2-methylpyrazole-3-carboxamide
CID 172891424
4-ethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]thiadiazole-5-carboxamide
CID 110107151
2-methyl-N-[1-(6-methylpyrazin-2-yl)piperidin-4-yl]pyrazole-3-carboxamide
CID 172891004
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124985226
N-[1-[3-bromo-5-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]-2-methylpyrazole-3-carboxamide
CID 172892155
2-(3,5-dimethylpyrazol-1-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124942990
N-[1-(6-bromo-1,3-benzothiazol-2-yl)piperidin-3-yl]-2-methylpyrazole-3-carboxamide
CID 172892678

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide?
The IUPAC name of 2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide (CID 125023608) is 2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide?
The canonical SMILES for 2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide is Cc1cccc(N2CCC[C@@H](NC(=O)c3ccnn3C)C2)n1.
What is the InChIKey of 2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide?
The InChIKey is YZKLDHBJBYJHTL-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H21N5O/c1-12-5-3-7-15(18-12)21-10-4-6-13(11-21)19-16(22)14-8-9-17-20(14)2/h3,5,7-9,13H,4,6,10-11H2,1-2H3,(H,19,22)/t13-/m1/s1.
What are the key properties of 2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide?
2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide has a molecular weight of 299.38 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrazole-3-carboxamide is sourced from PubChem (CID 125023608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).