6-methoxy-4-methylphthalazin-1-amine

C10H11N3O — CID 170258561

IUPAC6-methoxy-4-methylphthalazin-1-amine
SMILESCOc1ccc2c(N)nnc(C)c2c1
InChIInChI=1S/C10H11N3O/c1-6-9-5-7(14-2)3-4-8(9)10(11)13-12-6/h3-5H,1-2H3,(H2,11,13)
InChIKeyKRAVMQQXFIBGJJ-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.53
Rot. Bonds1

About 6-methoxy-4-methylphthalazin-1-amine

6-methoxy-4-methylphthalazin-1-amine (PubChem CID 170258561) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 6-methoxy-4-methylphthalazin-1-amine.

Molecular Properties

Compound Name6-methoxy-4-methylphthalazin-1-amine
PubChem CID170258561
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name6-methoxy-4-methylphthalazin-1-amine
SMILESCOc1ccc2c(N)nnc(C)c2c1
InChIInChI=1S/C10H11N3O/c1-6-9-5-7(14-2)3-4-8(9)10(11)13-12-6/h3-5H,1-2H3,(H2,11,13)
InChIKeyKRAVMQQXFIBGJJ-UHFFFAOYSA-N
XLogP1.53
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxyphthalazin-1-amine
CID 130119690
7-methoxy-1,4-dimethylisoquinoline
CID 72544129
4-bromo-6-methoxyisoquinolin-1-amine
CID 84707747
5-methoxy-1,2-benzothiazol-3-amine
CID 10035208
3-iodo-6-methoxy-2-methylquinolin-4-amine
CID 121236710
7-methoxy-4-methylquinolin-2-amine
CID 53485904
6-methoxy-2,4-dimethylquinolin-3-ol
CID 123803220
2,4,6-trimethoxynaphthalen-1-amine
CID 123693588
3,6-dimethoxy-1-methylisoquinoline
CID 169285036
7-methoxy-1-(7-methoxy-2-methylnaphthalen-1-yl)-2-methylnaphthalene
CID 20715432
4-deuterio-8-methoxy-6-methylphenanthridine
CID 175718583
1-(2,4-dimethoxyphenyl)-4-methylphthalazine
CID 77092719

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-methylphthalazin-1-amine?
The IUPAC name of 6-methoxy-4-methylphthalazin-1-amine (CID 170258561) is 6-methoxy-4-methylphthalazin-1-amine.
What is the SMILES notation for 6-methoxy-4-methylphthalazin-1-amine?
The canonical SMILES for 6-methoxy-4-methylphthalazin-1-amine is COc1ccc2c(N)nnc(C)c2c1.
What is the InChIKey of 6-methoxy-4-methylphthalazin-1-amine?
The InChIKey is KRAVMQQXFIBGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-6-9-5-7(14-2)3-4-8(9)10(11)13-12-6/h3-5H,1-2H3,(H2,11,13).
What are the key properties of 6-methoxy-4-methylphthalazin-1-amine?
6-methoxy-4-methylphthalazin-1-amine has a molecular weight of 189.22 g/mol, XLogP of 1.53, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-methylphthalazin-1-amine is sourced from PubChem (CID 170258561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).