1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide

C20H24N4O — CID 46597156

IUPAC1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide
SMILESO=C(Nc1cccc2c1CCCC2)C1CCCN(c2cnccn2)C1
InChIInChI=1S/C20H24N4O/c25-20(23-18-9-3-6-15-5-1-2-8-17(15)18)16-7-4-12-24(14-16)19-13-21-10-11-22-19/h3,6,9-11,13,16H,1-2,4-5,7-8,12,14H2,(H,23,25)
InChIKeyTXGKPNHTGDAAAZ-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.21
Rot. Bonds3

About 1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide

1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide (PubChem CID 46597156) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is 1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide
PubChem CID46597156
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC Name1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide
SMILESO=C(Nc1cccc2c1CCCC2)C1CCCN(c2cnccn2)C1
InChIInChI=1S/C20H24N4O/c25-20(23-18-9-3-6-15-5-1-2-8-17(15)18)16-7-4-12-24(14-16)19-13-21-10-11-22-19/h3,6,9-11,13,16H,1-2,4-5,7-8,12,14H2,(H,23,25)
InChIKeyTXGKPNHTGDAAAZ-UHFFFAOYSA-N
XLogP3.21
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-N-(6-methyl-2-pyridinyl)-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 36998696
N-(4-piperidin-1-ylphenyl)-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 47024919
(3S)-N-(4-piperidin-1-ylphenyl)-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 37070977
N-[3-(dimethylcarbamoyl)phenyl]-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 46597194
(3R)-N-(5-acetamido-2-chlorophenyl)-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 94632049
(3S)-N-(5-acetamido-2-chlorophenyl)-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 94632050
N-(3-propan-2-ylphenyl)-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 46573311
1-[1-(3-fluorophenyl)-6-oxopyridazin-3-yl]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide
CID 53071173
N-propan-2-yl-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 42950778
(3S)-1-pyrazin-2-yl-N-(1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide
CID 37027060
(3S)-N-(1-methylpyrazol-3-yl)-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 37000668
(3R)-N-[3-(azepan-1-ylsulfonyl)phenyl]-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 37025382

Frequently Asked Questions

What is the IUPAC name of 1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide?
The IUPAC name of 1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide (CID 46597156) is 1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide.
What is the SMILES notation for 1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide?
The canonical SMILES for 1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide is O=C(Nc1cccc2c1CCCC2)C1CCCN(c2cnccn2)C1.
What is the InChIKey of 1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide?
The InChIKey is TXGKPNHTGDAAAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c25-20(23-18-9-3-6-15-5-1-2-8-17(15)18)16-7-4-12-24(14-16)19-13-21-10-11-22-19/h3,6,9-11,13,16H,1-2,4-5,7-8,12,14H2,(H,23,25).
What are the key properties of 1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide?
1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide has a molecular weight of 336.44 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)piperidine-3-carboxamide is sourced from PubChem (CID 46597156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).