5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide

C19H17F2N5O2 — CID 118130799

IUPAC5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide
SMILESCc1cc(OC2CC2)ncc1-c1cc(C(=O)Nc2c(F)cncc2F)nn1C
InChIInChI=1S/C19H17F2N5O2/c1-10-5-17(28-11-3-4-11)23-7-12(10)16-6-15(25-26(16)2)19(27)24-18-13(20)8-22-9-14(18)21/h5-9,11H,3-4H2,1-2H3,(H,22,24,27)
InChIKeyUDVUZZBHFCGWMO-UHFFFAOYSA-N
MW385.37 g/mol
LogP3.26
Rot. Bonds5

About 5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide

5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide (PubChem CID 118130799) has the molecular formula C19H17F2N5O2 and a molecular weight of 385.37 g/mol. Its IUPAC name is 5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide
PubChem CID118130799
Molecular FormulaC19H17F2N5O2
Molecular Weight385.37 g/mol
Exact Mass385.14
IUPAC Name5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide
SMILESCc1cc(OC2CC2)ncc1-c1cc(C(=O)Nc2c(F)cncc2F)nn1C
InChIInChI=1S/C19H17F2N5O2/c1-10-5-17(28-11-3-4-11)23-7-12(10)16-6-15(25-26(16)2)19(27)24-18-13(20)8-22-9-14(18)21/h5-9,11H,3-4H2,1-2H3,(H,22,24,27)
InChIKeyUDVUZZBHFCGWMO-UHFFFAOYSA-N
XLogP3.26
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.37
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide?
The IUPAC name of 5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide (CID 118130799) is 5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide.
What is the SMILES notation for 5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide?
The canonical SMILES for 5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide is Cc1cc(OC2CC2)ncc1-c1cc(C(=O)Nc2c(F)cncc2F)nn1C.
What is the InChIKey of 5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide?
The InChIKey is UDVUZZBHFCGWMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F2N5O2/c1-10-5-17(28-11-3-4-11)23-7-12(10)16-6-15(25-26(16)2)19(27)24-18-13(20)8-22-9-14(18)21/h5-9,11H,3-4H2,1-2H3,(H,22,24,27).
What are the key properties of 5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide?
5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide has a molecular weight of 385.37 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-cyclopropyloxy-4-methyl-3-pyridinyl)-N-(3,5-difluoro-4-pyridinyl)-1-methylpyrazole-3-carboxamide is sourced from PubChem (CID 118130799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).