N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide

C17H21N5O2 — CID 138026197

IUPACN-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide
SMILESCCN(C(=O)C1CCC(=O)N(c2cnn(C)c2)C1)c1ccncc1
InChIInChI=1S/C17H21N5O2/c1-3-21(14-6-8-18-9-7-14)17(24)13-4-5-16(23)22(11-13)15-10-19-20(2)12-15/h6-10,12-13H,3-5,11H2,1-2H3
InChIKeyGESBKABXHCZFKR-UHFFFAOYSA-N
MW327.39 g/mol
LogP1.61
Rot. Bonds4

About N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide

N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide (PubChem CID 138026197) has the molecular formula C17H21N5O2 and a molecular weight of 327.39 g/mol. Its IUPAC name is N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide
PubChem CID138026197
Molecular FormulaC17H21N5O2
Molecular Weight327.39 g/mol
Exact Mass327.17
IUPAC NameN-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide
SMILESCCN(C(=O)C1CCC(=O)N(c2cnn(C)c2)C1)c1ccncc1
InChIInChI=1S/C17H21N5O2/c1-3-21(14-6-8-18-9-7-14)17(24)13-4-5-16(23)22(11-13)15-10-19-20(2)12-15/h6-10,12-13H,3-5,11H2,1-2H3
InChIKeyGESBKABXHCZFKR-UHFFFAOYSA-N
XLogP1.61
TPSA71.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-[3-hydroxy-3-(hydroxymethyl)azetidine-1-carbonyl]-1-(1-methylpyrazol-4-yl)piperidin-2-one
CID 136565324
1-[1-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carbonyl]-1,4-diazepan-5-one
CID 136563456
5-[3-(cyclopropylmethyl)-4-oxoimidazolidine-1-carbonyl]-1-(1-methylpyrazol-4-yl)piperidin-2-one
CID 167931670
1,3,3-trimethyl-4-[1-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carbonyl]piperazin-2-one
CID 136564463
(3R)-N-ethyl-5-oxo-N-pyridin-4-yl-1-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 129370499
5-(6,6-difluoro-1,4-oxazepane-4-carbonyl)-1-(1-methylpyrazol-4-yl)piperidin-2-one
CID 136565214
N-[2-(3-but-3-ynyldiazirin-3-yl)ethyl]-1-(1-methylpyrazol-4-yl)-6-oxopiperidine-3-carboxamide
CID 166409944
methyl (3R)-1-(1-methylpyrazol-4-yl)-5-oxopyrrolidine-3-carboxylate
CID 125424343
(3R)-1-(4-cyano-2-fluorophenyl)-N-ethyl-N-pyridin-4-ylpyrrolidine-3-carboxamide
CID 129487311
1-(3,4-dimethylphenyl)-5-[3-(pyridin-4-ylmethoxy)pyrrolidine-1-carbonyl]piperidin-2-one
CID 166187721
(3aS,7aR)-4-(1-methylpyrazol-4-yl)-1-(pyridine-4-carbonyl)-2,3,3a,6,7,7a-hexahydropyrrolo[3,2-b]pyridin-5-one
CID 97379366
4-amino-N-ethyl-N-pyridin-4-ylcyclopent-2-ene-1-carboxamide
CID 106935503

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide?
The IUPAC name of N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide (CID 138026197) is N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide.
What is the SMILES notation for N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide?
The canonical SMILES for N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide is CCN(C(=O)C1CCC(=O)N(c2cnn(C)c2)C1)c1ccncc1.
What is the InChIKey of N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide?
The InChIKey is GESBKABXHCZFKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O2/c1-3-21(14-6-8-18-9-7-14)17(24)13-4-5-16(23)22(11-13)15-10-19-20(2)12-15/h6-10,12-13H,3-5,11H2,1-2H3.
What are the key properties of N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide?
N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide has a molecular weight of 327.39 g/mol, XLogP of 1.61, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(1-methylpyrazol-4-yl)-6-oxo-N-pyridin-4-ylpiperidine-3-carboxamide is sourced from PubChem (CID 138026197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).