6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide

C22H25N5O — CID 138584981

IUPAC6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(c2ccn(-c3ccccc3)n2)C2CCN(C)CC2)cn1
InChIInChI=1S/C22H25N5O/c1-17-8-9-18(16-23-17)22(28)27(20-10-13-25(2)14-11-20)21-12-15-26(24-21)19-6-4-3-5-7-19/h3-9,12,15-16,20H,10-11,13-14H2,1-2H3
InChIKeyQLKYGYGAYURFKP-UHFFFAOYSA-N
MW375.48 g/mol
LogP3.32
Rot. Bonds4

About 6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide

6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide (PubChem CID 138584981) has the molecular formula C22H25N5O and a molecular weight of 375.48 g/mol. Its IUPAC name is 6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide
PubChem CID138584981
Molecular FormulaC22H25N5O
Molecular Weight375.48 g/mol
Exact Mass375.21
IUPAC Name6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(c2ccn(-c3ccccc3)n2)C2CCN(C)CC2)cn1
InChIInChI=1S/C22H25N5O/c1-17-8-9-18(16-23-17)22(28)27(20-10-13-25(2)14-11-20)21-12-15-26(24-21)19-6-4-3-5-7-19/h3-9,12,15-16,20H,10-11,13-14H2,1-2H3
InChIKeyQLKYGYGAYURFKP-UHFFFAOYSA-N
XLogP3.32
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.48
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 16069302
Dipyridodiazepinone deriv. 34
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6-(ethylcarbamoylamino)-4-pyrazol-1-yl-~{N}-pyridin-3-yl-pyridine-3-carboxamide
CID 138454245
N-(2,4-difluorophenyl)-6-(1H-pyrazol-1-yl)nicotinamide
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1-Cyclohexyl-4-{pyrazolo[1,5-a]pyridine-3-carbonyl}piperazine
CID 6619939
Phenyl-[4-[[(6-pyrazol-1-yl-2-pyridinyl)methylamino]methyl]piperidin-1-yl]methanone
CID 10499712
(3-Methylphenyl)-[4-[[(6-pyrazol-1-yl-2-pyridinyl)methylamino]methyl]piperidin-1-yl]methanone
CID 10644061
N-{1-[Amino(oxo)acetyl]pentyl}-2-(3-phenyl-1H-pyrazol-1-yl)nicotinamide
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N-(6-(3-(pyridin-3-yl)-5-(trifluoromethyl)-1H-pyrazol-1-yl)pyridazin-3-yl)benzamide
CID 50899554
N-[3,4-dioxo-1-phenyl-4-(prop-2-enylamino)butan-2-yl]-2-(3-phenylpyrazol-1-yl)pyridine-3-carboxamide
CID 53311527
N-[3,4-dioxo-1-phenyl-4-(propylamino)butan-2-yl]-2-(3-phenylpyrazol-1-yl)pyridine-3-carboxamide
CID 53311607
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CID 66561650

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide (CID 138584981) is 6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide is Cc1ccc(C(=O)N(c2ccn(-c3ccccc3)n2)C2CCN(C)CC2)cn1.
What is the InChIKey of 6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide?
The InChIKey is QLKYGYGAYURFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O/c1-17-8-9-18(16-23-17)22(28)27(20-10-13-25(2)14-11-20)21-12-15-26(24-21)19-6-4-3-5-7-19/h3-9,12,15-16,20H,10-11,13-14H2,1-2H3.
What are the key properties of 6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide?
6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide has a molecular weight of 375.48 g/mol, XLogP of 3.32, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(1-methylpiperidin-4-yl)-N-(1-phenylpyrazol-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 138584981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).