N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide

C15H18N4O2 — CID 106486744

IUPACN,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide
SMILESCNCc1ccc(Oc2ccc(C(=O)N(C)C)nn2)cc1
InChIInChI=1S/C15H18N4O2/c1-16-10-11-4-6-12(7-5-11)21-14-9-8-13(17-18-14)15(20)19(2)3/h4-9,16H,10H2,1-3H3
InChIKeyDDEDDQLJFNACQS-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.69
Rot. Bonds5

About N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide

N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide (PubChem CID 106486744) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide
PubChem CID106486744
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC NameN,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide
SMILESCNCc1ccc(Oc2ccc(C(=O)N(C)C)nn2)cc1
InChIInChI=1S/C15H18N4O2/c1-16-10-11-4-6-12(7-5-11)21-14-9-8-13(17-18-14)15(20)19(2)3/h4-9,16H,10H2,1-3H3
InChIKeyDDEDDQLJFNACQS-UHFFFAOYSA-N
XLogP1.69
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide
CID 106486781
N-methyl-1-[4-[6-(trifluoromethyl)pyridazin-3-yl]oxyphenyl]methanamine
CID 106486820
N,N-dimethyl-4-(methylaminomethyl)benzamide
CID 155590632
ethyl 6-[4-(methylaminomethyl)phenoxy]pyridine-3-carboxylate
CID 106486678
N,N-dimethyl-4-[3-(methylaminomethyl)phenoxy]pyridine-2-carboxamide
CID 106486623
6-hydrazinyl-N,N-dimethylpyridazine-3-carboxamide
CID 62236767
N-methyl-1-[4-(tetrazolo[1,5-b]pyridazin-6-yloxy)phenyl]methanamine
CID 106486859
2-methyl-4-[4-(methylaminomethyl)phenoxy]benzamide
CID 106486919
6-(4-propoxyphenoxy)pyridazine-3-carboxylic acid
CID 60790691
6-methyl-2-[4-(methylaminomethyl)phenoxy]pyridine-3-carboxamide
CID 106486726
6-(4-chlorophenoxy)pyridazine-3-carboxylic acid
CID 60791476
6-(4-acetamidophenoxy)-N-phenylpyridazine-3-carboxamide
CID 133313253

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide?
The IUPAC name of N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide (CID 106486744) is N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide.
What is the SMILES notation for N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide?
The canonical SMILES for N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide is CNCc1ccc(Oc2ccc(C(=O)N(C)C)nn2)cc1.
What is the InChIKey of N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide?
The InChIKey is DDEDDQLJFNACQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-16-10-11-4-6-12(7-5-11)21-14-9-8-13(17-18-14)15(20)19(2)3/h4-9,16H,10H2,1-3H3.
What are the key properties of N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide?
N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[4-(methylaminomethyl)phenoxy]pyridazine-3-carboxamide is sourced from PubChem (CID 106486744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).