N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide

C18H19FN6O2 — CID 59568394

IUPACN-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide
SMILESCc1onc(-c2ccc(F)cn2)c1CNc1cc(C(=O)NC2CC2)n(C)n1
InChIInChI=1S/C18H19FN6O2/c1-10-13(17(24-27-10)14-6-3-11(19)8-20-14)9-21-16-7-15(25(2)23-16)18(26)22-12-4-5-12/h3,6-8,12H,4-5,9H2,1-2H3,(H,21,23)(H,22,26)
InChIKeyFSQNZWDNQRDFGE-UHFFFAOYSA-N
MW370.39 g/mol
LogP2.42
Rot. Bonds6

About N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide

N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide (PubChem CID 59568394) has the molecular formula C18H19FN6O2 and a molecular weight of 370.39 g/mol. Its IUPAC name is N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide
PubChem CID59568394
Molecular FormulaC18H19FN6O2
Molecular Weight370.39 g/mol
Exact Mass370.16
IUPAC NameN-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide
SMILESCc1onc(-c2ccc(F)cn2)c1CNc1cc(C(=O)NC2CC2)n(C)n1
InChIInChI=1S/C18H19FN6O2/c1-10-13(17(24-27-10)14-6-3-11(19)8-20-14)9-21-16-7-15(25(2)23-16)18(26)22-12-4-5-12/h3,6-8,12H,4-5,9H2,1-2H3,(H,21,23)(H,22,26)
InChIKeyFSQNZWDNQRDFGE-UHFFFAOYSA-N
XLogP2.42
TPSA97.87 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.39
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide?
The IUPAC name of N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide (CID 59568394) is N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide?
The canonical SMILES for N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide is Cc1onc(-c2ccc(F)cn2)c1CNc1cc(C(=O)NC2CC2)n(C)n1.
What is the InChIKey of N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide?
The InChIKey is FSQNZWDNQRDFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN6O2/c1-10-13(17(24-27-10)14-6-3-11(19)8-20-14)9-21-16-7-15(25(2)23-16)18(26)22-12-4-5-12/h3,6-8,12H,4-5,9H2,1-2H3,(H,21,23)(H,22,26).
What are the key properties of N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide?
N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide has a molecular weight of 370.39 g/mol, XLogP of 2.42, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[[3-(5-fluoro-2-pyridinyl)-5-methyl-1,2-oxazol-4-yl]methylamino]-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 59568394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).