6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine

C14H12ClN3O — CID 126696122

IUPAC6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine
SMILESNc1n[nH]c2cc(OCc3cccc(Cl)c3)ccc12
InChIInChI=1S/C14H12ClN3O/c15-10-3-1-2-9(6-10)8-19-11-4-5-12-13(7-11)17-18-14(12)16/h1-7H,8H2,(H3,16,17,18)
InChIKeyNYOJYHBLIXBFGP-UHFFFAOYSA-N
MW273.72 g/mol
LogP3.38
Rot. Bonds3

About 6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine

6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine (PubChem CID 126696122) has the molecular formula C14H12ClN3O and a molecular weight of 273.72 g/mol. Its IUPAC name is 6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine.

Molecular Properties

Compound Name6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine
PubChem CID126696122
Molecular FormulaC14H12ClN3O
Molecular Weight273.72 g/mol
Exact Mass273.07
IUPAC Name6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine
SMILESNc1n[nH]c2cc(OCc3cccc(Cl)c3)ccc12
InChIInChI=1S/C14H12ClN3O/c15-10-3-1-2-9(6-10)8-19-11-4-5-12-13(7-11)17-18-14(12)16/h1-7H,8H2,(H3,16,17,18)
InChIKeyNYOJYHBLIXBFGP-UHFFFAOYSA-N
XLogP3.38
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.72
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(4-ethylphenyl)methoxy]-1H-indazol-3-amine
CID 126696095
(3-amino-1H-indazol-6-yl) N-[(3-chlorophenyl)methyl]carbamate
CID 68886644
6-[[4-(1,1-difluoroethyl)phenyl]methoxy]-1H-indazol-3-amine
CID 126716670
2-amino-5-[(3-chlorophenyl)methoxy]benzoic acid
CID 65125909
1-chloro-3-[(4-methoxyphenoxy)methyl]benzene
CID 112788879
2,5-bis[(3-chlorophenyl)methoxy]phenol
CID 139941886
5-[4-[(3-chlorophenyl)methoxy]phenyl]-2H-tetrazole
CID 10613243
[3-[(3-chlorophenyl)methoxy]phenyl]methanol
CID 28562037
2-[(3-chlorophenyl)methoxy]-3-fluoroaniline
CID 104831215
2-[(3-chlorophenyl)methoxy]pyrimidin-5-amine
CID 65127178
4-bromo-2-[(3-chlorophenyl)methoxy]aniline
CID 65342868
4-[(3-chlorophenyl)methoxy]naphthalen-1-amine
CID 63690468

Frequently Asked Questions

What is the IUPAC name of 6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine?
The IUPAC name of 6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine (CID 126696122) is 6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine.
What is the SMILES notation for 6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine?
The canonical SMILES for 6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine is Nc1n[nH]c2cc(OCc3cccc(Cl)c3)ccc12.
What is the InChIKey of 6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine?
The InChIKey is NYOJYHBLIXBFGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3O/c15-10-3-1-2-9(6-10)8-19-11-4-5-12-13(7-11)17-18-14(12)16/h1-7H,8H2,(H3,16,17,18).
What are the key properties of 6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine?
6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine has a molecular weight of 273.72 g/mol, XLogP of 3.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-chlorophenyl)methoxy]-1H-indazol-3-amine is sourced from PubChem (CID 126696122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).