5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide

C18H21FN4O — CID 109288653

IUPAC5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide
SMILESCCC1CCCCN1c1cnc(C(=O)Nc2cccc(F)c2)cn1
InChIInChI=1S/C18H21FN4O/c1-2-15-8-3-4-9-23(15)17-12-20-16(11-21-17)18(24)22-14-7-5-6-13(19)10-14/h5-7,10-12,15H,2-4,8-9H2,1H3,(H,22,24)
InChIKeyLDVPSTIQGNNIGB-UHFFFAOYSA-N
MW328.39 g/mol
LogP3.64
Rot. Bonds4

About 5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide

5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide (PubChem CID 109288653) has the molecular formula C18H21FN4O and a molecular weight of 328.39 g/mol. Its IUPAC name is 5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide
PubChem CID109288653
Molecular FormulaC18H21FN4O
Molecular Weight328.39 g/mol
Exact Mass328.17
IUPAC Name5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide
SMILESCCC1CCCCN1c1cnc(C(=O)Nc2cccc(F)c2)cn1
InChIInChI=1S/C18H21FN4O/c1-2-15-8-3-4-9-23(15)17-12-20-16(11-21-17)18(24)22-14-7-5-6-13(19)10-14/h5-7,10-12,15H,2-4,8-9H2,1H3,(H,22,24)
InChIKeyLDVPSTIQGNNIGB-UHFFFAOYSA-N
XLogP3.64
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyridazine-3-carboxamide
CID 109125838
N-(2,4-difluorophenyl)-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109288660
N-(2,6-dimethylphenyl)-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109288601
5-(2-ethylpiperidin-1-yl)-N-(2,3,4-trifluorophenyl)pyrazine-2-carboxamide
CID 109288675
5-(2-ethylpiperidin-1-yl)-N-[(2-fluorophenyl)methyl]pyrazine-2-carboxamide
CID 109281326
5-(2-ethylpiperidin-1-yl)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109288658
N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide
CID 109274707
5-(2-ethylpiperidin-1-yl)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109288627
6-(2-ethylpiperidin-1-yl)-N-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 109125825
methyl 5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxylate
CID 104696638
5-(2-ethylpiperidin-1-yl)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280798
5-(3,4-dihydro-2H-quinolin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109290679

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide (CID 109288653) is 5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide is CCC1CCCCN1c1cnc(C(=O)Nc2cccc(F)c2)cn1.
What is the InChIKey of 5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide?
The InChIKey is LDVPSTIQGNNIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN4O/c1-2-15-8-3-4-9-23(15)17-12-20-16(11-21-17)18(24)22-14-7-5-6-13(19)10-14/h5-7,10-12,15H,2-4,8-9H2,1H3,(H,22,24).
What are the key properties of 5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide?
5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide has a molecular weight of 328.39 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109288653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).