N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide

C22H21N5O3 — CID 72851940

IUPACN-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(Oc2ccccc2)nc1)C1CCN(C(=O)c2cnccn2)CC1
InChIInChI=1S/C22H21N5O3/c28-21(16-8-12-27(13-9-16)22(29)19-15-23-10-11-24-19)26-17-6-7-20(25-14-17)30-18-4-2-1-3-5-18/h1-7,10-11,14-16H,8-9,12-13H2,(H,26,28)
InChIKeyQDOZZRMBTWDDCU-UHFFFAOYSA-N
MW403.44 g/mol
LogP3.15
Rot. Bonds5

About N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide

N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide (PubChem CID 72851940) has the molecular formula C22H21N5O3 and a molecular weight of 403.44 g/mol. Its IUPAC name is N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide
PubChem CID72851940
Molecular FormulaC22H21N5O3
Molecular Weight403.44 g/mol
Exact Mass403.16
IUPAC NameN-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(Oc2ccccc2)nc1)C1CCN(C(=O)c2cnccn2)CC1
InChIInChI=1S/C22H21N5O3/c28-21(16-8-12-27(13-9-16)22(29)19-15-23-10-11-24-19)26-17-6-7-20(25-14-17)30-18-4-2-1-3-5-18/h1-7,10-11,14-16H,8-9,12-13H2,(H,26,28)
InChIKeyQDOZZRMBTWDDCU-UHFFFAOYSA-N
XLogP3.15
TPSA97.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.44
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(6-phenoxy-3-pyridinyl)-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 42101147
1-(2-methoxyacetyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide
CID 56852437
1-(furan-2-ylmethyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide
CID 24793063
(2S)-1-cyclobutyl-N-(6-phenoxy-3-pyridinyl)piperidine-2-carboxamide
CID 42286968
N-[6-[4-(4-methylpiperidine-1-carbonyl)phenoxy]-3-pyridinyl]cyclohexanecarboxamide
CID 50831942
1-(1,2-oxazol-3-ylmethyl)-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide
CID 42519623
N-(6-phenoxy-3-pyridinyl)-1-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide
CID 11719150
N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopropanecarboxamide
CID 117059029
1-(furan-2-carbonyl)-N-(3-pyrazin-2-yloxyphenyl)piperidine-4-carboxamide
CID 39263707
N-ethyl-1-(6-phenoxypyridine-3-carbonyl)piperidine-4-carboxamide
CID 87016013
(2R)-1-(1,2-oxazole-5-carbonyl)-N-(6-phenoxy-3-pyridinyl)piperidine-2-carboxamide
CID 97279481
(2S,4S)-2-methyl-N-(6-phenoxy-3-pyridinyl)piperidine-4-carboxamide;dihydrochloride
CID 120642212

Frequently Asked Questions

What is the IUPAC name of N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide (CID 72851940) is N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide is O=C(Nc1ccc(Oc2ccccc2)nc1)C1CCN(C(=O)c2cnccn2)CC1.
What is the InChIKey of N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide?
The InChIKey is QDOZZRMBTWDDCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5O3/c28-21(16-8-12-27(13-9-16)22(29)19-15-23-10-11-24-19)26-17-6-7-20(25-14-17)30-18-4-2-1-3-5-18/h1-7,10-11,14-16H,8-9,12-13H2,(H,26,28).
What are the key properties of N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide?
N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide has a molecular weight of 403.44 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-phenoxy-3-pyridinyl)-1-(pyrazine-2-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 72851940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).