6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine

C10H17N3O — CID 123926862

IUPAC6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine
SMILESCOc1nnc(N(C)C)cc1C(C)C
InChIInChI=1S/C10H17N3O/c1-7(2)8-6-9(13(3)4)11-12-10(8)14-5/h6-7H,1-5H3
InChIKeyDTZIWIQKNDDTAX-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.67
Rot. Bonds3

About 6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine

6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine (PubChem CID 123926862) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine.

Molecular Properties

Compound Name6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine
PubChem CID123926862
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine
SMILESCOc1nnc(N(C)C)cc1C(C)C
InChIInChI=1S/C10H17N3O/c1-7(2)8-6-9(13(3)4)11-12-10(8)14-5/h6-7H,1-5H3
InChIKeyDTZIWIQKNDDTAX-UHFFFAOYSA-N
XLogP1.67
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine?
The IUPAC name of 6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine (CID 123926862) is 6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine.
What is the SMILES notation for 6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine?
The canonical SMILES for 6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine is COc1nnc(N(C)C)cc1C(C)C.
What is the InChIKey of 6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine?
The InChIKey is DTZIWIQKNDDTAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-7(2)8-6-9(13(3)4)11-12-10(8)14-5/h6-7H,1-5H3.
What are the key properties of 6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine?
6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine has a molecular weight of 195.27 g/mol, XLogP of 1.67, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N,N-dimethyl-5-propan-2-ylpyridazin-3-amine is sourced from PubChem (CID 123926862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).