N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine

C14H12ClN3O — CID 24991698

IUPACN-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine
SMILESCOc1ccc2[nH]nc(Nc3cccc(Cl)c3)c2c1
InChIInChI=1S/C14H12ClN3O/c1-19-11-5-6-13-12(8-11)14(18-17-13)16-10-4-2-3-9(15)7-10/h2-8H,1H3,(H2,16,17,18)
InChIKeyKDHDBHGICNAFKA-UHFFFAOYSA-N
MW273.72 g/mol
LogP3.97
Rot. Bonds3

About N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine

N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine (PubChem CID 24991698) has the molecular formula C14H12ClN3O and a molecular weight of 273.72 g/mol. Its IUPAC name is N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine.

Molecular Properties

Compound NameN-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine
PubChem CID24991698
Molecular FormulaC14H12ClN3O
Molecular Weight273.72 g/mol
Exact Mass273.07
IUPAC NameN-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine
SMILESCOc1ccc2[nH]nc(Nc3cccc(Cl)c3)c2c1
InChIInChI=1S/C14H12ClN3O/c1-19-11-5-6-13-12(8-11)14(18-17-13)16-10-4-2-3-9(15)7-10/h2-8H,1H3,(H2,16,17,18)
InChIKeyKDHDBHGICNAFKA-UHFFFAOYSA-N
XLogP3.97
TPSA49.94 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 ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-(3-chlorophenyl)-5-N-(2-methoxyethyl)-5-N-methyl-1H-indazole-3,5-diamine
CID 91327669
5-(3-chlorophenyl)-3-N-(3-methoxyphenyl)-1H-pyrazole-3,4-diamine
CID 57025885
1-benzyl-N-(3-chlorophenyl)-5-methoxyindazol-3-amine
CID 69189312
N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 692374
3-[3-(3-chloroanilino)-5-methoxyindazol-1-yl]benzaldehyde
CID 25097509
2-(3-chloroanilino)-6-methoxyquinoline-3-carboxylic acid
CID 10131496
3-N-phenyl-1H-indazole-3,5-diamine
CID 89172388
6-chloro-7-fluoro-N,5-diphenyl-1H-indazol-3-amine;6-chloro-7-fluoro-N-(3-methoxyphenyl)-5-phenyl-1H-indazol-3-amine;6-chloro-7-fluoro-N-(4-methoxyphenyl)-5-phenyl-1H-indazol-3-amine
CID 157126465
N-(3-chlorophenyl)-3,4,5-trimethoxyaniline
CID 102029180
4-(3-chloroanilino)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109220984
ethyl 3-(3-chloroanilino)-5-methyl-1H-pyrazole-4-carboxylate
CID 14500687
4-N-(3-chlorophenyl)-6-N-[(4-methoxyphenyl)methyl]pyrimidine-4,6-diamine
CID 112860263

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine?
The IUPAC name of N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine (CID 24991698) is N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine.
What is the SMILES notation for N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine?
The canonical SMILES for N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine is COc1ccc2[nH]nc(Nc3cccc(Cl)c3)c2c1.
What is the InChIKey of N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine?
The InChIKey is KDHDBHGICNAFKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3O/c1-19-11-5-6-13-12(8-11)14(18-17-13)16-10-4-2-3-9(15)7-10/h2-8H,1H3,(H2,16,17,18).
What are the key properties of N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine?
N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine has a molecular weight of 273.72 g/mol, XLogP of 3.97, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-5-methoxy-1H-indazol-3-amine is sourced from PubChem (CID 24991698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).