1-(ethoxymethyl)indazol-6-amine

C10H13N3O — CID 65369977

IUPAC1-(ethoxymethyl)indazol-6-amine
SMILESCCOCn1ncc2ccc(N)cc21
InChIInChI=1S/C10H13N3O/c1-2-14-7-13-10-5-9(11)4-3-8(10)6-12-13/h3-6H,2,7,11H2,1H3
InChIKeyPTUSFDOCDPNOQR-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.61
Rot. Bonds3

About 1-(ethoxymethyl)indazol-6-amine

1-(ethoxymethyl)indazol-6-amine (PubChem CID 65369977) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 1-(ethoxymethyl)indazol-6-amine.

Molecular Properties

Compound Name1-(ethoxymethyl)indazol-6-amine
PubChem CID65369977
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name1-(ethoxymethyl)indazol-6-amine
SMILESCCOCn1ncc2ccc(N)cc21
InChIInChI=1S/C10H13N3O/c1-2-14-7-13-10-5-9(11)4-3-8(10)6-12-13/h3-6H,2,7,11H2,1H3
InChIKeyPTUSFDOCDPNOQR-UHFFFAOYSA-N
XLogP1.61
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(ethoxymethyl)indazol-6-amine?
The IUPAC name of 1-(ethoxymethyl)indazol-6-amine (CID 65369977) is 1-(ethoxymethyl)indazol-6-amine.
What is the SMILES notation for 1-(ethoxymethyl)indazol-6-amine?
The canonical SMILES for 1-(ethoxymethyl)indazol-6-amine is CCOCn1ncc2ccc(N)cc21.
What is the InChIKey of 1-(ethoxymethyl)indazol-6-amine?
The InChIKey is PTUSFDOCDPNOQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-2-14-7-13-10-5-9(11)4-3-8(10)6-12-13/h3-6H,2,7,11H2,1H3.
What are the key properties of 1-(ethoxymethyl)indazol-6-amine?
1-(ethoxymethyl)indazol-6-amine has a molecular weight of 191.23 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethoxymethyl)indazol-6-amine is sourced from PubChem (CID 65369977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).