5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide

C17H18N4O3 — CID 651949

IUPAC5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)cn1
InChIInChI=1S/C17H18N4O3/c1-12-10-19-15(11-18-12)16(22)20-14-5-3-2-4-13(14)17(23)21-6-8-24-9-7-21/h2-5,10-11H,6-9H2,1H3,(H,20,22)
InChIKeyTXPQPBACWRVULP-UHFFFAOYSA-N
MW326.36 g/mol
LogP1.51
Rot. Bonds3

About 5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide

5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide (PubChem CID 651949) has the molecular formula C17H18N4O3 and a molecular weight of 326.36 g/mol. Its IUPAC name is 5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide
PubChem CID651949
Molecular FormulaC17H18N4O3
Molecular Weight326.36 g/mol
Exact Mass326.14
IUPAC Name5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide
SMILESCc1cnc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)cn1
InChIInChI=1S/C17H18N4O3/c1-12-10-19-15(11-18-12)16(22)20-14-5-3-2-4-13(14)17(23)21-6-8-24-9-7-21/h2-5,10-11H,6-9H2,1H3,(H,20,22)
InChIKeyTXPQPBACWRVULP-UHFFFAOYSA-N
XLogP1.51
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[4-[(3-ethyl-2-oxidanylidene-1~{H}-quinolin-7-yl)methyl]piperazin-1-yl]-~{N}-methyl-pyridine-2-carboxamide
CID 156596360
N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxopyridin-3-yl)pyridin-3-yl]-3-(trifluoromethyl)benzamide
CID 90442604
N-(1',2-dimethyl-5'-morpholino-6'-oxo-1',6'-dihydro-[3,3'-bipyridin]-5-yl)-2-(trifluoromethyl)isonicotinamide
CID 117609603
N-[6-methyl-5-(5-morpholin-4-yl-6-oxo-1H-pyridin-3-yl)pyridin-3-yl]-3-(trifluoromethyl)benzamide
CID 117610044
N-(3-acetylphenyl)pyrazine-2-carboxamide
CID 862105
N-(4-morpholin-4-ylphenyl)pyrazine-2-carboxamide
CID 7409168
2-benzamido-N-pyridin-3-ylbenzamide
CID 730923
2-Fluoro-N-[(E)-1-(morpholine-4-carbonyl)-2-pyridin-3-yl-vinyl]-benzamide
CID 1835917
N-[2-(2,6-dimethylanilino)-2-oxoethyl]pyrazine-2-carboxamide
CID 4785773
N-(2-{[(2-methylphenyl)carbonyl]amino}ethyl)pyrazine-2-carboxamide
CID 6498552
N-(2-{[(3-methylphenyl)carbonyl]amino}ethyl)pyrazine-2-carboxamide
CID 6498553
N-(3-{[(2-methylphenyl)carbonyl]amino}propyl)pyrazine-2-carboxamide
CID 6498580

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide?
The IUPAC name of 5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide (CID 651949) is 5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide?
The canonical SMILES for 5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide is Cc1cnc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)cn1.
What is the InChIKey of 5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide?
The InChIKey is TXPQPBACWRVULP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3/c1-12-10-19-15(11-18-12)16(22)20-14-5-3-2-4-13(14)17(23)21-6-8-24-9-7-21/h2-5,10-11H,6-9H2,1H3,(H,20,22).
What are the key properties of 5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide?
5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide has a molecular weight of 326.36 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[2-(morpholine-4-carbonyl)phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 651949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).