1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide

C24H33N5O3 — CID 163295438

IUPAC1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide
SMILESCOc1nccc(-c2cc(C(=O)N3CCC(C(=O)NC4CCC(C)CC4)CC3)[nH]n2)c1C
InChIInChI=1S/C24H33N5O3/c1-15-4-6-18(7-5-15)26-22(30)17-9-12-29(13-10-17)24(31)21-14-20(27-28-21)19-8-11-25-23(32-3)16(19)2/h8,11,14-15,17-18H,4-7,9-10,12-13H2,1-3H3,(H,26,30)(H,27,28)
InChIKeyHCXFBNLNOZHZQC-UHFFFAOYSA-N
MW439.56 g/mol
LogP3.34
Rot. Bonds5

About 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide

1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide (PubChem CID 163295438) has the molecular formula C24H33N5O3 and a molecular weight of 439.56 g/mol. Its IUPAC name is 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide
PubChem CID163295438
Molecular FormulaC24H33N5O3
Molecular Weight439.56 g/mol
Exact Mass439.26
IUPAC Name1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide
SMILESCOc1nccc(-c2cc(C(=O)N3CCC(C(=O)NC4CCC(C)CC4)CC3)[nH]n2)c1C
InChIInChI=1S/C24H33N5O3/c1-15-4-6-18(7-5-15)26-22(30)17-9-12-29(13-10-17)24(31)21-14-20(27-28-21)19-8-11-25-23(32-3)16(19)2/h8,11,14-15,17-18H,4-7,9-10,12-13H2,1-3H3,(H,26,30)(H,27,28)
InChIKeyHCXFBNLNOZHZQC-UHFFFAOYSA-N
XLogP3.34
TPSA100.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.56
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide with MolForge

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Related Compounds

1-[3-(2-cyclopropyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide
CID 163295763
4-[5-[4-[(4-methylcyclohexyl)carbamoyl]piperidine-1-carbonyl]-1H-pyrazol-3-yl]pyridine-2-carboxylic acid
CID 169006139
N-(4-methylcyclohexyl)-1-(3-pyrimidin-4-yl-1H-pyrazole-5-carbonyl)piperidine-4-carboxamide
CID 163294964
1-[3-[2-(dimethylamino)-4-pyridinyl]-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide
CID 167375375
1-[3-[2-(difluoromethoxy)-4-pyridinyl]-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide
CID 167375058
N-cyclooctyl-1-(3-pyridin-4-yl-1H-pyrazole-5-carbonyl)piperidine-4-carboxamide
CID 53087505
N-(1-methylpiperidin-4-yl)-1-(3-pyridin-4-yl-1H-pyrazole-5-carbonyl)piperidine-4-carboxamide
CID 163295106
N-cyclopentyl-1-(3-pyridin-3-yl-1H-pyrazole-5-carbonyl)piperidine-4-carboxamide
CID 53087604
1-[3-(5-chloro-2-methoxy-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(5-oxopyrrolidin-3-yl)piperidine-4-carboxamide
CID 163295488
[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-(4-methylpiperidin-1-yl)methanone
CID 20864968
4-methoxy-N-[1-[3-(2-methylphenyl)-1H-pyrazole-5-carbonyl]piperidin-4-yl]benzamide
CID 53156071
(3S)-N-cyclopropyl-1-(3-pyridin-2-yl-1H-pyrazole-5-carbonyl)piperidine-3-carboxamide
CID 92892702

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide?
The IUPAC name of 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide (CID 163295438) is 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide?
The canonical SMILES for 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide is COc1nccc(-c2cc(C(=O)N3CCC(C(=O)NC4CCC(C)CC4)CC3)[nH]n2)c1C.
What is the InChIKey of 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide?
The InChIKey is HCXFBNLNOZHZQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N5O3/c1-15-4-6-18(7-5-15)26-22(30)17-9-12-29(13-10-17)24(31)21-14-20(27-28-21)19-8-11-25-23(32-3)16(19)2/h8,11,14-15,17-18H,4-7,9-10,12-13H2,1-3H3,(H,26,30)(H,27,28).
What are the key properties of 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide?
1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide has a molecular weight of 439.56 g/mol, XLogP of 3.34, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-methoxy-3-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-methylcyclohexyl)piperidine-4-carboxamide is sourced from PubChem (CID 163295438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).