2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide

C20H22N6O — CID 126768033

IUPAC2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide
SMILESCN1CCN(c2cc(C(=O)Nc3ccccc3-n3cccn3)ccn2)CC1
InChIInChI=1S/C20H22N6O/c1-24-11-13-25(14-12-24)19-15-16(7-9-21-19)20(27)23-17-5-2-3-6-18(17)26-10-4-8-22-26/h2-10,15H,11-14H2,1H3,(H,23,27)
InChIKeyNPIAKZKAVPFDNC-UHFFFAOYSA-N
MW362.44 g/mol
LogP2.27
Rot. Bonds4

About 2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide

2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide (PubChem CID 126768033) has the molecular formula C20H22N6O and a molecular weight of 362.44 g/mol. Its IUPAC name is 2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide
PubChem CID126768033
Molecular FormulaC20H22N6O
Molecular Weight362.44 g/mol
Exact Mass362.19
IUPAC Name2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide
SMILESCN1CCN(c2cc(C(=O)Nc3ccccc3-n3cccn3)ccn2)CC1
InChIInChI=1S/C20H22N6O/c1-24-11-13-25(14-12-24)19-15-16(7-9-21-19)20(27)23-17-5-2-3-6-18(17)26-10-4-8-22-26/h2-10,15H,11-14H2,1H3,(H,23,27)
InChIKeyNPIAKZKAVPFDNC-UHFFFAOYSA-N
XLogP2.27
TPSA66.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.44
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-methylpiperazin-1-yl)-N-[2-(5-methylpyrazol-1-yl)phenyl]pyridine-4-carboxamide
CID 126780133
N-(4-hydroxy-2-methylphenyl)-2-(4-methylpiperazin-1-yl)pyridine-4-carboxamide
CID 84573364
2-(4-ethylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-4-carboxamide
CID 109168802
2-(4-methylpiperazin-1-yl)pyridine-4-carboxylic acid
CID 6484238
N-(6-amino-3-pyridinyl)-2-(4-methylpiperazin-1-yl)pyridine-4-carboxamide;dihydrochloride
CID 119516349
N-[2-(ethylamino)-4-methylphenyl]-2-(4-methylpiperazin-1-yl)pyridine-4-carboxamide
CID 119047944
2-(4-methylpiperazin-1-yl)-N-(1-phenylcyclopropyl)pyridine-4-carboxamide
CID 56788391
4-propan-2-yl-N-(2-pyrazol-1-ylphenyl)benzamide
CID 47045211
N-(2-bromophenyl)-2-(4-methylpiperidin-1-yl)pyridine-4-carboxamide
CID 109166535
methyl 2-[3-[(2-pyrazol-1-ylphenyl)carbamoyl]phenoxy]acetate
CID 154774881
2-(4-methylpiperazin-1-yl)-N-pyrrolidin-3-ylpyridine-4-carboxamide
CID 119453711
2-(4-methylpiperazin-1-yl)-N-(7-pyridin-2-ylquinazolin-2-yl)pyridine-4-carboxamide
CID 138587517

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide (CID 126768033) is 2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide is CN1CCN(c2cc(C(=O)Nc3ccccc3-n3cccn3)ccn2)CC1.
What is the InChIKey of 2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide?
The InChIKey is NPIAKZKAVPFDNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N6O/c1-24-11-13-25(14-12-24)19-15-16(7-9-21-19)20(27)23-17-5-2-3-6-18(17)26-10-4-8-22-26/h2-10,15H,11-14H2,1H3,(H,23,27).
What are the key properties of 2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide?
2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide has a molecular weight of 362.44 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpiperazin-1-yl)-N-(2-pyrazol-1-ylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 126768033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).