N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide

C18H17N5O3 — CID 67158115

IUPACN-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide
SMILESCc1onc(-c2ccncc2)c1COc1ccc(C(=O)NC2CC2)nn1
InChIInChI=1S/C18H17N5O3/c1-11-14(17(23-26-11)12-6-8-19-9-7-12)10-25-16-5-4-15(21-22-16)18(24)20-13-2-3-13/h4-9,13H,2-3,10H2,1H3,(H,20,24)
InChIKeyAABJYLNVZLLMPQ-UHFFFAOYSA-N
MW351.37 g/mol
LogP2.31
Rot. Bonds6

About N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide

N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide (PubChem CID 67158115) has the molecular formula C18H17N5O3 and a molecular weight of 351.37 g/mol. Its IUPAC name is N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide
PubChem CID67158115
Molecular FormulaC18H17N5O3
Molecular Weight351.37 g/mol
Exact Mass351.13
IUPAC NameN-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide
SMILESCc1onc(-c2ccncc2)c1COc1ccc(C(=O)NC2CC2)nn1
InChIInChI=1S/C18H17N5O3/c1-11-14(17(23-26-11)12-6-8-19-9-7-12)10-25-16-5-4-15(21-22-16)18(24)20-13-2-3-13/h4-9,13H,2-3,10H2,1H3,(H,20,24)
InChIKeyAABJYLNVZLLMPQ-UHFFFAOYSA-N
XLogP2.31
TPSA103.03 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.37
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide?
The IUPAC name of N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide (CID 67158115) is N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide is Cc1onc(-c2ccncc2)c1COc1ccc(C(=O)NC2CC2)nn1.
What is the InChIKey of N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide?
The InChIKey is AABJYLNVZLLMPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O3/c1-11-14(17(23-26-11)12-6-8-19-9-7-12)10-25-16-5-4-15(21-22-16)18(24)20-13-2-3-13/h4-9,13H,2-3,10H2,1H3,(H,20,24).
What are the key properties of N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide?
N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide has a molecular weight of 351.37 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide is sourced from PubChem (CID 67158115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).