1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine

C11H14FN3O — CID 119088227

IUPAC1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine
SMILESCOCC(N)Cn1ncc2ccc(F)cc21
InChIInChI=1S/C11H14FN3O/c1-16-7-10(13)6-15-11-4-9(12)3-2-8(11)5-14-15/h2-5,10H,6-7,13H2,1H3
InChIKeyRZQVXNHUKWWFKF-UHFFFAOYSA-N
MW223.25 g/mol
LogP1.15
Rot. Bonds4

About 1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine

1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine (PubChem CID 119088227) has the molecular formula C11H14FN3O and a molecular weight of 223.25 g/mol. Its IUPAC name is 1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine.

Molecular Properties

Compound Name1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine
PubChem CID119088227
Molecular FormulaC11H14FN3O
Molecular Weight223.25 g/mol
Exact Mass223.11
IUPAC Name1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine
SMILESCOCC(N)Cn1ncc2ccc(F)cc21
InChIInChI=1S/C11H14FN3O/c1-16-7-10(13)6-15-11-4-9(12)3-2-8(11)5-14-15/h2-5,10H,6-7,13H2,1H3
InChIKeyRZQVXNHUKWWFKF-UHFFFAOYSA-N
XLogP1.15
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-fluoroindazol-1-yl)acetaldehyde
CID 83827825
1-benzyl-6-fluoroindazole
CID 83414179
6-fluoroindazol-1-amine
CID 83413973
1-methoxy-3-(6-nitroindazol-1-yl)propan-2-ol
CID 63930886
1-(azetidin-3-ylmethyl)-6-fluoroindazole
CID 141365019
6-fluoro-1-(3-methoxy-2-methylpropyl)benzimidazol-2-amine
CID 62376506
6-fluoro-1-[(1-methylpyrrolidin-2-yl)methyl]indazole
CID 174227473
(2S)-1-(6-methylsulfonylindazol-1-yl)propan-2-amine
CID 10220646
1-[(2,4-difluorophenyl)methyl]indazol-6-amine
CID 62197807
1-[(3-chlorophenyl)methyl]-6-fluoroindazole
CID 141202076
6-fluoro-N,N-dimethylindazol-1-amine
CID 175715573
1-(3-methoxypropyl)-6-methylindazole
CID 66596206

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine?
The IUPAC name of 1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine (CID 119088227) is 1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine.
What is the SMILES notation for 1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine?
The canonical SMILES for 1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine is COCC(N)Cn1ncc2ccc(F)cc21.
What is the InChIKey of 1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine?
The InChIKey is RZQVXNHUKWWFKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN3O/c1-16-7-10(13)6-15-11-4-9(12)3-2-8(11)5-14-15/h2-5,10H,6-7,13H2,1H3.
What are the key properties of 1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine?
1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine has a molecular weight of 223.25 g/mol, XLogP of 1.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoroindazol-1-yl)-3-methoxypropan-2-amine is sourced from PubChem (CID 119088227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).