N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide

C17H20N4O3 — CID 4063626

IUPACN-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide
SMILESCOc1ccc(NC(=O)c2cn[nH]c2C(=O)N2CCCCC2)cc1
InChIInChI=1S/C17H20N4O3/c1-24-13-7-5-12(6-8-13)19-16(22)14-11-18-20-15(14)17(23)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10H2,1H3,(H,18,20)(H,19,22)
InChIKeyQTEFIXROYVSXBX-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.30
Rot. Bonds4

About N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide

N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide (PubChem CID 4063626) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide
PubChem CID4063626
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC NameN-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide
SMILESCOc1ccc(NC(=O)c2cn[nH]c2C(=O)N2CCCCC2)cc1
InChIInChI=1S/C17H20N4O3/c1-24-13-7-5-12(6-8-13)19-16(22)14-11-18-20-15(14)17(23)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10H2,1H3,(H,18,20)(H,19,22)
InChIKeyQTEFIXROYVSXBX-UHFFFAOYSA-N
XLogP2.30
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-methoxyphenyl)-3-[4-(piperidine-1-carbonyl)phenyl]urea
CID 1289713
N-(4-methoxyphenyl)-5-[(3S)-3-(piperidine-1-carbonyl)piperidine-1-carbonyl]-1,3,4-thiadiazole-2-carboxamide
CID 92890782
N-(4-methoxyphenyl)-1,6-diazacycloundecane-1-carboxamide
CID 144843106
N-(4-methoxyphenyl)-2-piperidin-1-ylpyrimidine-5-carboxamide
CID 109250209
3-(azepane-1-carbonyl)-N-(4-methoxyphenyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 109071776
5-[4-[2-(azepan-1-yl)-2-oxoethyl]piperidine-1-carbonyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
CID 46330995
5-(azepan-1-yl)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109196895
N-(4-methoxyphenyl)-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109145697
N-(4-methoxyphenyl)piperidine-1-carbothioamide
CID 883440
[2-(4-methoxyanilino)pyrimidin-5-yl]-pyrrolidin-1-ylmethanone
CID 109249327
[5-(4-methoxyanilino)-3-pyridinyl]-piperidin-1-ylmethanone
CID 109226378
N-[(4-methoxyphenyl)carbamoyl]pyrrolidine-1-carboxamide
CID 175001605

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide (CID 4063626) is N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide is COc1ccc(NC(=O)c2cn[nH]c2C(=O)N2CCCCC2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide?
The InChIKey is QTEFIXROYVSXBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c1-24-13-7-5-12(6-8-13)19-16(22)14-11-18-20-15(14)17(23)21-9-3-2-4-10-21/h5-8,11H,2-4,9-10H2,1H3,(H,18,20)(H,19,22).
What are the key properties of N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide?
N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide has a molecular weight of 328.37 g/mol, XLogP of 2.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-5-(piperidine-1-carbonyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 4063626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).