6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride

C19H20ClN5O — CID 67241156

IUPAC6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(-n2cccn2)nc1
InChIInChI=1S/C19H19N5O.ClH/c25-19(16-4-7-18(21-13-16)24-11-1-9-22-24)23-17-5-2-14(3-6-17)15-8-10-20-12-15;/h1-7,9,11,13,15,20H,8,10,12H2,(H,23,25);1H
InChIKeyIFUZISOPRFBLDQ-UHFFFAOYSA-N
MW369.86 g/mol
LogP3.02
Rot. Bonds4

About 6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride

6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride (PubChem CID 67241156) has the molecular formula C19H20ClN5O and a molecular weight of 369.86 g/mol. Its IUPAC name is 6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride
PubChem CID67241156
Molecular FormulaC19H20ClN5O
Molecular Weight369.86 g/mol
Exact Mass369.14
IUPAC Name6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(-n2cccn2)nc1
InChIInChI=1S/C19H19N5O.ClH/c25-19(16-4-7-18(21-13-16)24-11-1-9-22-24)23-17-5-2-14(3-6-17)15-8-10-20-12-15;/h1-7,9,11,13,15,20H,8,10,12H2,(H,23,25);1H
InChIKeyIFUZISOPRFBLDQ-UHFFFAOYSA-N
XLogP3.02
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.86
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[(3S)-pyrrolidin-3-yl]phenyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride
CID 67239256
N-cyclohexyl-6-pyrazol-1-ylpyridine-3-carboxamide
CID 16654230
4-chloro-N-[4-[(3S)-pyrrolidin-3-yl]phenyl]benzamide
CID 124561571
N-methyl-6-pyrazol-1-ylpyridine-3-carboxamide
CID 3758867
N-(3-fluorophenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
CID 16654238
N-[4-[(3S)-piperidin-3-yl]phenyl]-6-propylpyridine-3-carboxamide
CID 67241110
4-ethynyl-N-(4-pyrrolidin-3-ylphenyl)benzamide
CID 53250757
4-[[(2S)-oxolan-2-yl]methoxy]-N-(6-pyrazol-1-yl-3-pyridinyl)benzamide
CID 25333571
N-(4-fluorophenyl)-6-piperidin-3-ylpyridine-3-carboxamide
CID 110085480
N-(6-pyrazol-1-yl-3-pyridinyl)pyrrolidine-2-carboxamide
CID 43426246
4-methyl-N-[4-[(3S)-piperidin-3-yl]phenyl]benzamide
CID 124566433
1-phenyl-3-[4-[(3R)-pyrrolidin-3-yl]phenyl]urea
CID 124566335

Frequently Asked Questions

What is the IUPAC name of 6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride?
The IUPAC name of 6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride (CID 67241156) is 6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride.
What is the SMILES notation for 6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride?
The canonical SMILES for 6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride is Cl.O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(-n2cccn2)nc1.
What is the InChIKey of 6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride?
The InChIKey is IFUZISOPRFBLDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O.ClH/c25-19(16-4-7-18(21-13-16)24-11-1-9-22-24)23-17-5-2-14(3-6-17)15-8-10-20-12-15;/h1-7,9,11,13,15,20H,8,10,12H2,(H,23,25);1H.
What are the key properties of 6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride?
6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride has a molecular weight of 369.86 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyrazol-1-yl-N-(4-pyrrolidin-3-ylphenyl)pyridine-3-carboxamide;hydrochloride is sourced from PubChem (CID 67241156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).