5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide

C14H14ClN3O2 — CID 103817156

IUPAC5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
SMILESCC(C)Oc1ccccc1NC(=O)c1cnc(Cl)cn1
InChIInChI=1S/C14H14ClN3O2/c1-9(2)20-12-6-4-3-5-10(12)18-14(19)11-7-17-13(15)8-16-11/h3-9H,1-2H3,(H,18,19)
InChIKeyKPTASFHWHOLKQO-UHFFFAOYSA-N
MW291.74 g/mol
LogP3.17
Rot. Bonds4

About 5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide

5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide (PubChem CID 103817156) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is 5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
PubChem CID103817156
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC Name5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
SMILESCC(C)Oc1ccccc1NC(=O)c1cnc(Cl)cn1
InChIInChI=1S/C14H14ClN3O2/c1-9(2)20-12-6-4-3-5-10(12)18-14(19)11-7-17-13(15)8-16-11/h3-9H,1-2H3,(H,18,19)
InChIKeyKPTASFHWHOLKQO-UHFFFAOYSA-N
XLogP3.17
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-methoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293616
5-[4-(dimethylamino)anilino]-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293832
5-(4-formylpiperazin-1-yl)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109278980
N-(2-propan-2-yloxyphenyl)-2H-triazole-4-carboxamide
CID 47370046
6-N-propan-2-yl-2-N-(2-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide
CID 109093744
5-(3-methoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293523
5-(4-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293748
4-chloro-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 81227462
5-[2-(4-fluorophenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109284560
5-(furan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109279576
N-(2-propan-2-yloxyphenyl)-1,2-oxazole-3-carboxamide
CID 110693809
2-chloro-5-fluoro-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 103891998

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide (CID 103817156) is 5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide is CC(C)Oc1ccccc1NC(=O)c1cnc(Cl)cn1.
What is the InChIKey of 5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide?
The InChIKey is KPTASFHWHOLKQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c1-9(2)20-12-6-4-3-5-10(12)18-14(19)11-7-17-13(15)8-16-11/h3-9H,1-2H3,(H,18,19).
What are the key properties of 5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide?
5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide has a molecular weight of 291.74 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 103817156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).