6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide

C17H18N6O2 — CID 96566827

IUPAC6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide
SMILESCOc1ccc([C@@H](Nc2cncc(C(N)=O)n2)c2nccn2C)cc1
InChIInChI=1S/C17H18N6O2/c1-23-8-7-20-17(23)15(11-3-5-12(25-2)6-4-11)22-14-10-19-9-13(21-14)16(18)24/h3-10,15H,1-2H3,(H2,18,24)(H,21,22)/t15-/m1/s1
InChIKeyUVSRGEIXMMXXIC-OAHLLOKOSA-N
MW338.37 g/mol
LogP1.52
Rot. Bonds6

About 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide

6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide (PubChem CID 96566827) has the molecular formula C17H18N6O2 and a molecular weight of 338.37 g/mol. Its IUPAC name is 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide
PubChem CID96566827
Molecular FormulaC17H18N6O2
Molecular Weight338.37 g/mol
Exact Mass338.15
IUPAC Name6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide
SMILESCOc1ccc([C@@H](Nc2cncc(C(N)=O)n2)c2nccn2C)cc1
InChIInChI=1S/C17H18N6O2/c1-23-8-7-20-17(23)15(11-3-5-12(25-2)6-4-11)22-14-10-19-9-13(21-14)16(18)24/h3-10,15H,1-2H3,(H2,18,24)(H,21,22)/t15-/m1/s1
InChIKeyUVSRGEIXMMXXIC-OAHLLOKOSA-N
XLogP1.52
TPSA107.95 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide with MolForge

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Related Compounds

N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]propanamide
CID 46528475
3-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-1,1-dimethylurea
CID 110429250
N-[(S)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 40939556
4-amino-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]pentanamide
CID 120564384
3,4-dimethoxy-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]benzamide
CID 46528524
N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-6-methylpyridine-3-carboxamide
CID 46451083
4-methoxy-N-[(S)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]pyrimidin-2-amine
CID 35784614
N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-4,6-dipyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 42941869
N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]cyclobutanecarboxamide
CID 46528505
1-[(2R)-2-hydroxypropyl]-3-[(S)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]urea
CID 94027654
2-(4-chlorophenyl)sulfanyl-N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]acetamide
CID 24535478
N-[(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-1H-pyrrole-2-carboxamide
CID 110429336

Frequently Asked Questions

What is the IUPAC name of 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide?
The IUPAC name of 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide (CID 96566827) is 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide.
What is the SMILES notation for 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide?
The canonical SMILES for 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide is COc1ccc([C@@H](Nc2cncc(C(N)=O)n2)c2nccn2C)cc1.
What is the InChIKey of 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide?
The InChIKey is UVSRGEIXMMXXIC-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H18N6O2/c1-23-8-7-20-17(23)15(11-3-5-12(25-2)6-4-11)22-14-10-19-9-13(21-14)16(18)24/h3-10,15H,1-2H3,(H2,18,24)(H,21,22)/t15-/m1/s1.
What are the key properties of 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide?
6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide has a molecular weight of 338.37 g/mol, XLogP of 1.52, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(R)-(4-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amino]pyrazine-2-carboxamide is sourced from PubChem (CID 96566827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).