(7-methoxy-1,3-dimethylindazol-5-yl)methanamine

C11H15N3O — CID 117109848

IUPAC(7-methoxy-1,3-dimethylindazol-5-yl)methanamine
SMILESCOc1cc(CN)cc2c(C)nn(C)c12
InChIInChI=1S/C11H15N3O/c1-7-9-4-8(6-12)5-10(15-3)11(9)14(2)13-7/h4-5H,6,12H2,1-3H3
InChIKeyATBTUMFSXVVMPV-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.35
Rot. Bonds2

About (7-methoxy-1,3-dimethylindazol-5-yl)methanamine

(7-methoxy-1,3-dimethylindazol-5-yl)methanamine (PubChem CID 117109848) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is (7-methoxy-1,3-dimethylindazol-5-yl)methanamine.

Molecular Properties

Compound Name(7-methoxy-1,3-dimethylindazol-5-yl)methanamine
PubChem CID117109848
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name(7-methoxy-1,3-dimethylindazol-5-yl)methanamine
SMILESCOc1cc(CN)cc2c(C)nn(C)c12
InChIInChI=1S/C11H15N3O/c1-7-9-4-8(6-12)5-10(15-3)11(9)14(2)13-7/h4-5H,6,12H2,1-3H3
InChIKeyATBTUMFSXVVMPV-UHFFFAOYSA-N
XLogP1.35
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[(1,3-dimethylindazol-7-yl)oxymethyl]phenyl]methanamine
CID 167478547
(7-methoxy-3-methyl-2H-indazol-5-yl)methanamine
CID 117109639
(4-methoxy-1-methylindol-6-yl)methanamine
CID 82603456
[3,5-dimethoxy-4-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]methanamine
CID 114527174
[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]methanamine
CID 68592145
(6-methoxy-2,3-dimethylindazol-5-yl)methanamine
CID 117110401
2-(7-methoxy-3-methylindazol-1-yl)ethanamine
CID 84673302
(1,3,6-trimethylpyrazolo[5,4-b]pyridin-5-yl)methanamine
CID 82504722
[3,5-dimethoxy-4-(4-methoxybutoxy)phenyl]methanamine
CID 104646966
[3-bromo-5-methoxy-4-[(2-methyltetrazol-5-yl)methoxy]phenyl]methanamine
CID 107041278
N-[(3,4-dimethoxyphenyl)methyl]-2-(1,3-dimethyl-7-oxopyrazolo[5,4-c]pyridin-6-yl)propanamide
CID 46395134
[5-chloro-2-[(4-chloro-1,3-dimethylpyrazol-5-yl)methoxy]-3-methoxyphenyl]methanamine
CID 104664220

Frequently Asked Questions

What is the IUPAC name of (7-methoxy-1,3-dimethylindazol-5-yl)methanamine?
The IUPAC name of (7-methoxy-1,3-dimethylindazol-5-yl)methanamine (CID 117109848) is (7-methoxy-1,3-dimethylindazol-5-yl)methanamine.
What is the SMILES notation for (7-methoxy-1,3-dimethylindazol-5-yl)methanamine?
The canonical SMILES for (7-methoxy-1,3-dimethylindazol-5-yl)methanamine is COc1cc(CN)cc2c(C)nn(C)c12.
What is the InChIKey of (7-methoxy-1,3-dimethylindazol-5-yl)methanamine?
The InChIKey is ATBTUMFSXVVMPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-7-9-4-8(6-12)5-10(15-3)11(9)14(2)13-7/h4-5H,6,12H2,1-3H3.
What are the key properties of (7-methoxy-1,3-dimethylindazol-5-yl)methanamine?
(7-methoxy-1,3-dimethylindazol-5-yl)methanamine has a molecular weight of 205.26 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methoxy-1,3-dimethylindazol-5-yl)methanamine is sourced from PubChem (CID 117109848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).