N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide

C16H18N4O2 — CID 109273814

IUPACN-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
SMILESCOc1ccccc1NC(=O)c1cnc(N2CCCC2)cn1
InChIInChI=1S/C16H18N4O2/c1-22-14-7-3-2-6-12(14)19-16(21)13-10-18-15(11-17-13)20-8-4-5-9-20/h2-3,6-7,10-11H,4-5,8-9H2,1H3,(H,19,21)
InChIKeyAFEPZULADRCKGB-UHFFFAOYSA-N
MW298.35 g/mol
LogP2.34
Rot. Bonds4

About N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide

N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide (PubChem CID 109273814) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
PubChem CID109273814
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC NameN-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
SMILESCOc1ccccc1NC(=O)c1cnc(N2CCCC2)cn1
InChIInChI=1S/C16H18N4O2/c1-22-14-7-3-2-6-12(14)19-16(21)13-10-18-15(11-17-13)20-8-4-5-9-20/h2-3,6-7,10-11H,4-5,8-9H2,1H3,(H,19,21)
InChIKeyAFEPZULADRCKGB-UHFFFAOYSA-N
XLogP2.34
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(azepan-1-yl)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109289350
N-(2-fluorophenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109273799
5-(2-ethylpiperidin-1-yl)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109288627
N-(2,3-dimethylphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109273787
5-(azepan-1-yl)-N-(3,4-dimethoxyphenyl)pyrazine-2-carboxamide
CID 109289360
5-(4-methylpiperazin-1-yl)-N-(2-phenoxyphenyl)pyrazine-2-carboxamide
CID 109278397
5-(4-formylpiperazin-1-yl)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109278980
N-(2-methoxyphenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyrazine-2-carboxamide
CID 109293406
5-(4-formylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 109278979
N-(2,5-dimethoxyphenyl)-5-morpholin-4-ylpyrazine-2-carboxamide
CID 109276688
5-(4-ethylpiperazin-1-yl)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 109278676
N-cyclopentyl-5-[4-(2-methoxyphenyl)piperazin-1-yl]pyrazine-2-carboxamide
CID 109273939

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide (CID 109273814) is N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide is COc1ccccc1NC(=O)c1cnc(N2CCCC2)cn1.
What is the InChIKey of N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide?
The InChIKey is AFEPZULADRCKGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c1-22-14-7-3-2-6-12(14)19-16(21)13-10-18-15(11-17-13)20-8-4-5-9-20/h2-3,6-7,10-11H,4-5,8-9H2,1H3,(H,19,21).
What are the key properties of N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide?
N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide is sourced from PubChem (CID 109273814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).