[1-(oxan-2-yl)indazol-6-yl]methanamine

C13H17N3O — CID 18616200

IUPAC[1-(oxan-2-yl)indazol-6-yl]methanamine
SMILESNCc1ccc2cnn(C3CCCCO3)c2c1
InChIInChI=1S/C13H17N3O/c14-8-10-4-5-11-9-15-16(12(11)7-10)13-3-1-2-6-17-13/h4-5,7,9,13H,1-3,6,8,14H2
InChIKeyGPVUUKQSRJTLIV-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.19
Rot. Bonds2

About [1-(oxan-2-yl)indazol-6-yl]methanamine

[1-(oxan-2-yl)indazol-6-yl]methanamine (PubChem CID 18616200) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is [1-(oxan-2-yl)indazol-6-yl]methanamine.

Molecular Properties

Compound Name[1-(oxan-2-yl)indazol-6-yl]methanamine
PubChem CID18616200
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name[1-(oxan-2-yl)indazol-6-yl]methanamine
SMILESNCc1ccc2cnn(C3CCCCO3)c2c1
InChIInChI=1S/C13H17N3O/c14-8-10-4-5-11-9-15-16(12(11)7-10)13-3-1-2-6-17-13/h4-5,7,9,13H,1-3,6,8,14H2
InChIKeyGPVUUKQSRJTLIV-UHFFFAOYSA-N
XLogP2.19
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

bromomethyl 1-(oxan-2-yl)indazole-6-carboxylate
CID 168860829
1-[(2S)-oxan-2-yl]indazole
CID 124562379
5-benzyl-1-(oxan-2-yl)indazole
CID 156734105
3-[1-(oxan-2-yl)indazol-6-yl]prop-2-enamide
CID 175874414
1-(oxan-2-yl)-5-(oxetan-3-ylmethyl)indazole
CID 178036760
5-chloro-1-(oxan-2-yl)indazole
CID 138754771
6-bromo-1-(oxan-2-yl)pyrazolo[4,3-c]pyridine
CID 121228962
1-(oxan-2-yl)indazole-5-carbonitrile
CID 58125480
6-ethyl-1-(oxan-2-yl)indazol-4-amine
CID 175161622
5-methyl-1-(oxan-2-yl)indazol-6-ol
CID 137284218
5-bromo-6-chloro-1-(oxan-2-yl)indazole
CID 139347721
2-bromo-1-[1-(oxan-2-yl)indazol-5-yl]ethanone
CID 170560839

Frequently Asked Questions

What is the IUPAC name of [1-(oxan-2-yl)indazol-6-yl]methanamine?
The IUPAC name of [1-(oxan-2-yl)indazol-6-yl]methanamine (CID 18616200) is [1-(oxan-2-yl)indazol-6-yl]methanamine.
What is the SMILES notation for [1-(oxan-2-yl)indazol-6-yl]methanamine?
The canonical SMILES for [1-(oxan-2-yl)indazol-6-yl]methanamine is NCc1ccc2cnn(C3CCCCO3)c2c1.
What is the InChIKey of [1-(oxan-2-yl)indazol-6-yl]methanamine?
The InChIKey is GPVUUKQSRJTLIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c14-8-10-4-5-11-9-15-16(12(11)7-10)13-3-1-2-6-17-13/h4-5,7,9,13H,1-3,6,8,14H2.
What are the key properties of [1-(oxan-2-yl)indazol-6-yl]methanamine?
[1-(oxan-2-yl)indazol-6-yl]methanamine has a molecular weight of 231.30 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(oxan-2-yl)indazol-6-yl]methanamine is sourced from PubChem (CID 18616200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).