N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide

C18H24N4O3 — CID 120919245

IUPACN-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCCOc1ccc(NC(=O)C2(n3cccn3)CCNCC2)cc1OC
InChIInChI=1S/C18H24N4O3/c1-3-25-15-6-5-14(13-16(15)24-2)21-17(23)18(7-10-19-11-8-18)22-12-4-9-20-22/h4-6,9,12-13,19H,3,7-8,10-11H2,1-2H3,(H,21,23)
InChIKeyOSCXEFSJJMIHSB-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.01
Rot. Bonds6

About N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide

N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide (PubChem CID 120919245) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
PubChem CID120919245
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC NameN-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCCOc1ccc(NC(=O)C2(n3cccn3)CCNCC2)cc1OC
InChIInChI=1S/C18H24N4O3/c1-3-25-15-6-5-14(13-16(15)24-2)21-17(23)18(7-10-19-11-8-18)22-12-4-9-20-22/h4-6,9,12-13,19H,3,7-8,10-11H2,1-2H3,(H,21,23)
InChIKeyOSCXEFSJJMIHSB-UHFFFAOYSA-N
XLogP2.01
TPSA77.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-methoxy-3-(2-methoxyethoxy)phenyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120924281
N-(3,4-dipropoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120918139
N-[(4-ethoxy-3-methoxyphenyl)methyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120922992
N-(3,4-dimethylphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120917006
N-(4-ethylphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120917507
N-(4-ethoxy-3-methoxyphenyl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 120618116
N-[3-(2,2-difluoroethoxy)-4-methylphenyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120930337
methyl 2-[3-[(4-pyrazol-1-ylpiperidine-4-carbonyl)amino]phenoxy]acetate
CID 120922883
N-(3-propoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120923034
N-(2-methyl-4-pyridinyl)-4-pyrazol-1-ylpiperidine-4-carboxamide;dihydrochloride
CID 120938072
dimethyl 5-[(4-pyrazol-1-ylpiperidine-4-carbonyl)amino]benzene-1,3-dicarboxylate
CID 120917447
N-[3-(butanoylamino)phenyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120924327

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The IUPAC name of N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide (CID 120919245) is N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide is CCOc1ccc(NC(=O)C2(n3cccn3)CCNCC2)cc1OC.
What is the InChIKey of N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The InChIKey is OSCXEFSJJMIHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-3-25-15-6-5-14(13-16(15)24-2)21-17(23)18(7-10-19-11-8-18)22-12-4-9-20-22/h4-6,9,12-13,19H,3,7-8,10-11H2,1-2H3,(H,21,23).
What are the key properties of N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide has a molecular weight of 344.42 g/mol, XLogP of 2.01, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxy-3-methoxyphenyl)-4-pyrazol-1-ylpiperidine-4-carboxamide is sourced from PubChem (CID 120919245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).