(2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone

C19H24N4O — CID 109288501

IUPAC(2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone
SMILESCCC1CCCCN1C(=O)c1cnc(N(C)c2ccccc2)cn1
InChIInChI=1S/C19H24N4O/c1-3-15-9-7-8-12-23(15)19(24)17-13-21-18(14-20-17)22(2)16-10-5-4-6-11-16/h4-6,10-11,13-15H,3,7-9,12H2,1-2H3
InChIKeyQPLVQZRAWSAWSQ-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.65
Rot. Bonds4

About (2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone

(2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone (PubChem CID 109288501) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is (2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone.

Molecular Properties

Compound Name(2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone
PubChem CID109288501
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name(2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone
SMILESCCC1CCCCN1C(=O)c1cnc(N(C)c2ccccc2)cn1
InChIInChI=1S/C19H24N4O/c1-3-15-9-7-8-12-23(15)19(24)17-13-21-18(14-20-17)22(2)16-10-5-4-6-11-16/h4-6,10-11,13-15H,3,7-9,12H2,1-2H3
InChIKeyQPLVQZRAWSAWSQ-UHFFFAOYSA-N
XLogP3.65
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-(2-ethylpiperidine-1-carbonyl)-N-phenylpyridine-2-carboxamide
CID 109099642
(4-benzylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone
CID 109288466
(2-ethylpiperidin-1-yl)-(5-hydrazinylpyrazin-2-yl)methanone
CID 107378063
[5-(2-chloroanilino)pyrazin-2-yl]-(2-ethylpiperidin-1-yl)methanone
CID 109288522
[6-[(2S)-2-ethylpiperidine-1-carbonyl]-2-pyridinyl]-[(2S)-2-ethylpiperidin-1-yl]methanone
CID 40585097
[5-(benzylamino)-2-pyridinyl]-(2-ethylpiperidin-1-yl)methanone
CID 109188025
(5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone
CID 107257609
(2-ethylpiperidin-1-yl)-[5-[4-(2-fluorophenyl)piperazin-1-yl]pyrazin-2-yl]methanone
CID 109286501
5-[2-(benzamidomethyl)piperidine-1-carbonyl]pyrazine-2-carboxylic acid
CID 120690266
(2-ethylpiperidin-1-yl)-(5-morpholin-4-ylpyrazin-2-yl)methanone
CID 109276634
3-[6-(2-ethylpiperidine-1-carbonyl)-3-pyridinyl]prop-2-enoic acid
CID 76978681
(2-ethylpiperidin-1-yl)-[5-(2-methoxyethylamino)pyrazin-2-yl]methanone
CID 109275908

Frequently Asked Questions

What is the IUPAC name of (2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone?
The IUPAC name of (2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone (CID 109288501) is (2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone.
What is the SMILES notation for (2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone?
The canonical SMILES for (2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone is CCC1CCCCN1C(=O)c1cnc(N(C)c2ccccc2)cn1.
What is the InChIKey of (2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone?
The InChIKey is QPLVQZRAWSAWSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-3-15-9-7-8-12-23(15)19(24)17-13-21-18(14-20-17)22(2)16-10-5-4-6-11-16/h4-6,10-11,13-15H,3,7-9,12H2,1-2H3.
What are the key properties of (2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone?
(2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone has a molecular weight of 324.43 g/mol, XLogP of 3.65, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone is sourced from PubChem (CID 109288501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).