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

C19H18FN5O2 — CID 67158061

IUPACN-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide
SMILESCc1onc(-c2ccc(F)cc2)c1CNc1ccc(C(=O)NC2CC2)nn1
InChIInChI=1S/C19H18FN5O2/c1-11-15(18(25-27-11)12-2-4-13(20)5-3-12)10-21-17-9-8-16(23-24-17)19(26)22-14-6-7-14/h2-5,8-9,14H,6-7,10H2,1H3,(H,21,24)(H,22,26)
InChIKeyNTNSQISHVNQNFM-UHFFFAOYSA-N
MW367.38 g/mol
LogP3.08
Rot. Bonds6

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

N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide (PubChem CID 67158061) has the molecular formula C19H18FN5O2 and a molecular weight of 367.38 g/mol. Its IUPAC name is N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide
PubChem CID67158061
Molecular FormulaC19H18FN5O2
Molecular Weight367.38 g/mol
Exact Mass367.14
IUPAC NameN-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide
SMILESCc1onc(-c2ccc(F)cc2)c1CNc1ccc(C(=O)NC2CC2)nn1
InChIInChI=1S/C19H18FN5O2/c1-11-15(18(25-27-11)12-2-4-13(20)5-3-12)10-21-17-9-8-16(23-24-17)19(26)22-14-6-7-14/h2-5,8-9,14H,6-7,10H2,1H3,(H,21,24)(H,22,26)
InChIKeyNTNSQISHVNQNFM-UHFFFAOYSA-N
XLogP3.08
TPSA92.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.38
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide with MolForge

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Related Compounds

6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methylamino]-N-(2,2,2-trifluoroethyl)pyridazine-3-carboxamide
CID 67157780
N-cyclopropyl-6-[(5-methyl-3-pyridin-4-yl-1,2-oxazol-4-yl)methoxy]pyridazine-3-carboxamide
CID 67158115
3-(4-fluorophenyl)-5-methyl-N-(4-phenylcyclohexyl)-1,2-oxazole-4-carboxamide
CID 39128435
N-cyclopentyl-6-[2-(4-fluorophenyl)ethylamino]pyridazine-3-carboxamide
CID 109112300
6-[[5-methyl-3-[6-(trifluoromethyl)-3-pyridinyl]-1,2-oxazol-4-yl]methoxy]-N-(oxan-4-yl)pyridazine-3-carboxamide
CID 134588508
6-(ethylamino)-N-(4-hydroxycyclohexyl)pyridazine-3-carboxamide
CID 55042745
N-cyclopentyl-6-[(3-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109112282
N-(4-ethoxycyclohexyl)-6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide
CID 134604565
6-[(2,5-dimethyl-1,3-thiazol-4-yl)methylamino]-N-(oxan-4-yl)pyridazine-3-carboxamide
CID 133406333
N-cycloheptyl-6-(ethylamino)pyridazine-3-carboxamide
CID 55042572
N-[4-(2,2-difluoroethoxy)cyclohexyl]-6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide
CID 134588497
N-cyclopropyl-3-(4-fluorophenyl)-5-(1-hydroxyethyl)-1,2-oxazole-4-carboxamide
CID 162880928

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide?
The IUPAC name of N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide (CID 67158061) is N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide is Cc1onc(-c2ccc(F)cc2)c1CNc1ccc(C(=O)NC2CC2)nn1.
What is the InChIKey of N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide?
The InChIKey is NTNSQISHVNQNFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN5O2/c1-11-15(18(25-27-11)12-2-4-13(20)5-3-12)10-21-17-9-8-16(23-24-17)19(26)22-14-6-7-14/h2-5,8-9,14H,6-7,10H2,1H3,(H,21,24)(H,22,26).
What are the key properties of N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide?
N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide has a molecular weight of 367.38 g/mol, XLogP of 3.08, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 67158061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).