N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide

C18H19FN6O3 — CID 70234150

IUPACN-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide
SMILESCOc1cnc(C(=O)Nc2ccnc(C3(C)CC(=O)N(C)C(N)=N3)c2)c(F)c1
InChIInChI=1S/C18H19FN6O3/c1-18(8-14(26)25(2)17(20)24-18)13-6-10(4-5-21-13)23-16(27)15-12(19)7-11(28-3)9-22-15/h4-7,9H,8H2,1-3H3,(H2,20,24)(H,21,23,27)
InChIKeyIKHAZRCRUOEJNS-UHFFFAOYSA-N
MW386.39 g/mol
LogP1.27
Rot. Bonds4

About N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide

N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide (PubChem CID 70234150) has the molecular formula C18H19FN6O3 and a molecular weight of 386.39 g/mol. Its IUPAC name is N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide
PubChem CID70234150
Molecular FormulaC18H19FN6O3
Molecular Weight386.39 g/mol
Exact Mass386.15
IUPAC NameN-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide
SMILESCOc1cnc(C(=O)Nc2ccnc(C3(C)CC(=O)N(C)C(N)=N3)c2)c(F)c1
InChIInChI=1S/C18H19FN6O3/c1-18(8-14(26)25(2)17(20)24-18)13-6-10(4-5-21-13)23-16(27)15-12(19)7-11(28-3)9-22-15/h4-7,9H,8H2,1-3H3,(H2,20,24)(H,21,23,27)
InChIKeyIKHAZRCRUOEJNS-UHFFFAOYSA-N
XLogP1.27
TPSA122.80 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.39
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Launch Full Analysis

Related Compounds

N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-4,5-dichloro-1,2-thiazole-3-carboxamide
CID 70235107
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-5-hydroxypyridine-2-carboxamide
CID 70233565
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-5-methoxy-1-benzofuran-2-carboxamide
CID 70235636
N-[3-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)phenyl]-3,5-dimethoxypyridine-2-carboxamide
CID 45381259
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 70232328
N-[3-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)phenyl]-3-fluoro-5-(trifluoromethyl)pyridine-2-carboxamide
CID 70234798
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-2-chloro-1,3-oxazole-4-carboxamide
CID 70232154
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-5-(triazol-1-yl)pyrazine-2-carboxamide
CID 70234907
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]quinoline-2-carboxamide
CID 70234249
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-5-pent-2-ynoxypyrazine-2-carboxamide
CID 70233346
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]pyrrolo[1,2-c]pyrimidine-3-carboxamide
CID 70234985
N-[3-[(4aS,7S,7aR)-3-amino-2,7-dimethyl-1,1-dioxo-7,7a-dihydro-5H-furo[3,4-e][1,2,4]thiadiazin-4a-yl]-4-fluorophenyl]-3-fluoro-5-methoxypyridine-2-carboxamide
CID 71468495

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide?
The IUPAC name of N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide (CID 70234150) is N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide.
What is the SMILES notation for N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide?
The canonical SMILES for N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide is COc1cnc(C(=O)Nc2ccnc(C3(C)CC(=O)N(C)C(N)=N3)c2)c(F)c1.
What is the InChIKey of N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide?
The InChIKey is IKHAZRCRUOEJNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN6O3/c1-18(8-14(26)25(2)17(20)24-18)13-6-10(4-5-21-13)23-16(27)15-12(19)7-11(28-3)9-22-15/h4-7,9H,8H2,1-3H3,(H2,20,24)(H,21,23,27).
What are the key properties of N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide?
N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide has a molecular weight of 386.39 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)-4-pyridinyl]-3-fluoro-5-methoxypyridine-2-carboxamide is sourced from PubChem (CID 70234150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).