N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride

C15H21Cl2N5O — CID 119441469

IUPACN-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride
SMILESCN(C(=O)c1cc(-n2cccn2)ccn1)C1CCNCC1.Cl.Cl
InChIInChI=1S/C15H19N5O.2ClH/c1-19(12-3-7-16-8-4-12)15(21)14-11-13(5-9-17-14)20-10-2-6-18-20;;/h2,5-6,9-12,16H,3-4,7-8H2,1H3;2*1H
InChIKeyKETLEVONOYGUGV-UHFFFAOYSA-N
MW358.27 g/mol
LogP1.93
Rot. Bonds3

About N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride

N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride (PubChem CID 119441469) has the molecular formula C15H21Cl2N5O and a molecular weight of 358.27 g/mol. Its IUPAC name is N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride
PubChem CID119441469
Molecular FormulaC15H21Cl2N5O
Molecular Weight358.27 g/mol
Exact Mass357.11
IUPAC NameN-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride
SMILESCN(C(=O)c1cc(-n2cccn2)ccn1)C1CCNCC1.Cl.Cl
InChIInChI=1S/C15H19N5O.2ClH/c1-19(12-3-7-16-8-4-12)15(21)14-11-13(5-9-17-14)20-10-2-6-18-20;;/h2,5-6,9-12,16H,3-4,7-8H2,1H3;2*1H
InChIKeyKETLEVONOYGUGV-UHFFFAOYSA-N
XLogP1.93
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.27
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylbenzamide;hydrochloride
CID 68723933
N-methyl-4-phenoxy-N-piperidin-4-ylpyridine-2-carboxamide
CID 119443292
N-methyl-N-piperidin-4-ylpyrazine-2-carboxamide;hydrochloride
CID 71641434
N-methyl-N-piperidin-4-ylpyrazine-2-carboxamide
CID 43602062
N-(azepan-4-yl)-N-methyl-2-(4-pyrazol-1-ylphenyl)acetamide
CID 154863649
N,1-dimethyl-N-piperidin-4-ylpyrazole-3-carboxamide
CID 103120629
N-(3-amino-2,2-dimethylpropyl)-N-methyl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride
CID 119652843
N-piperidin-4-yl-N-propyl-4-pyrazol-1-ylbenzamide;hydrochloride
CID 119824042
N-cyclopropyl-N-[(2-methoxyphenyl)methyl]-4-pyrazol-1-ylpyridine-2-carboxamide
CID 122140934
1,4-diazepan-1-yl-(4-pyrazol-1-yl-2-pyridinyl)methanone
CID 119414516
N-methyl-N-piperidin-3-yl-4-pyrazol-1-ylbenzamide
CID 175264909
N-cyclohexyl-4-[(3R)-3-hydroxypyrrolidin-1-yl]-N-methylpyridine-2-carboxamide
CID 56912622

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride?
The IUPAC name of N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride (CID 119441469) is N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride.
What is the SMILES notation for N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride?
The canonical SMILES for N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride is CN(C(=O)c1cc(-n2cccn2)ccn1)C1CCNCC1.Cl.Cl.
What is the InChIKey of N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride?
The InChIKey is KETLEVONOYGUGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O.2ClH/c1-19(12-3-7-16-8-4-12)15(21)14-11-13(5-9-17-14)20-10-2-6-18-20;;/h2,5-6,9-12,16H,3-4,7-8H2,1H3;2*1H.
What are the key properties of N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride?
N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride has a molecular weight of 358.27 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-piperidin-4-yl-4-pyrazol-1-ylpyridine-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119441469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).