N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide

C37H30F2N10O4 — CID 69147803

IUPACN-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide
SMILESCOc1cncc(-c2nc(NC(=O)C3CC3)cnc2-c2ccncc2F)c1.O=C(Nc1cnc(-c2ccncc2F)c(-c2ccc(=O)[nH]c2)n1)C1CC1
InChIInChI=1S/C19H16FN5O2.C18H14FN5O2/c1-27-13-6-12(7-22-8-13)17-18(14-4-5-21-9-15(14)20)23-10-16(24-17)25-19(26)11-2-3-11;19-13-8-20-6-5-12(13)17-16(11-3-4-15(25)21-7-11)23-14(9-22-17)24-18(26)10-1-2-10/h4-11H,2-3H2,1H3,(H,24,25,26);3-10H,1-2H2,(H,21,25)(H,23,24,26)
InChIKeyLQRXNMGIICTHPC-UHFFFAOYSA-N
MW716.71 g/mol
LogP5.48
Rot. Bonds9

About N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide

N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide (PubChem CID 69147803) has the molecular formula C37H30F2N10O4 and a molecular weight of 716.71 g/mol. Its IUPAC name is N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide
PubChem CID69147803
Molecular FormulaC37H30F2N10O4
Molecular Weight716.71 g/mol
Exact Mass716.24
IUPAC NameN-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide
SMILESCOc1cncc(-c2nc(NC(=O)C3CC3)cnc2-c2ccncc2F)c1.O=C(Nc1cnc(-c2ccncc2F)c(-c2ccc(=O)[nH]c2)n1)C1CC1
InChIInChI=1S/C19H16FN5O2.C18H14FN5O2/c1-27-13-6-12(7-22-8-13)17-18(14-4-5-21-9-15(14)20)23-10-16(24-17)25-19(26)11-2-3-11;19-13-8-20-6-5-12(13)17-16(11-3-4-15(25)21-7-11)23-14(9-22-17)24-18(26)10-1-2-10/h4-11H,2-3H2,1H3,(H,24,25,26);3-10H,1-2H2,(H,21,25)(H,23,24,26)
InChIKeyLQRXNMGIICTHPC-UHFFFAOYSA-N
XLogP5.48
TPSA190.52 Ų
H-Bond Donors3
H-Bond Acceptors11
Rotatable Bonds9
Heavy Atoms53
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500716.71
LogP ≤ 55.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1011

Analyze N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide?
The IUPAC name of N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide (CID 69147803) is N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide is COc1cncc(-c2nc(NC(=O)C3CC3)cnc2-c2ccncc2F)c1.O=C(Nc1cnc(-c2ccncc2F)c(-c2ccc(=O)[nH]c2)n1)C1CC1.
What is the InChIKey of N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide?
The InChIKey is LQRXNMGIICTHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN5O2.C18H14FN5O2/c1-27-13-6-12(7-22-8-13)17-18(14-4-5-21-9-15(14)20)23-10-16(24-17)25-19(26)11-2-3-11;19-13-8-20-6-5-12(13)17-16(11-3-4-15(25)21-7-11)23-14(9-22-17)24-18(26)10-1-2-10/h4-11H,2-3H2,1H3,(H,24,25,26);3-10H,1-2H2,(H,21,25)(H,23,24,26).
What are the key properties of N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide?
N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide has a molecular weight of 716.71 g/mol, XLogP of 5.48, 9 rotatable bonds, 3 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3-fluoro-4-pyridinyl)-6-(5-methoxy-3-pyridinyl)pyrazin-2-yl]cyclopropanecarboxamide;N-[5-(3-fluoro-4-pyridinyl)-6-(6-oxo-1H-pyridin-3-yl)pyrazin-2-yl]cyclopropanecarboxamide is sourced from PubChem (CID 69147803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).