6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine

C15H19N3O2 — CID 66489467

IUPAC6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine
SMILESCOc1ccc(C2Cc3[nH]ncc3C(N)C2)c(OC)c1
InChIInChI=1S/C15H19N3O2/c1-19-10-3-4-11(15(7-10)20-2)9-5-13(16)12-8-17-18-14(12)6-9/h3-4,7-9,13H,5-6,16H2,1-2H3,(H,17,18)
InChIKeyAPDCQNAHPISFBL-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.16
Rot. Bonds3

About 6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine

6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine (PubChem CID 66489467) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine.

Molecular Properties

Compound Name6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine
PubChem CID66489467
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine
SMILESCOc1ccc(C2Cc3[nH]ncc3C(N)C2)c(OC)c1
InChIInChI=1S/C15H19N3O2/c1-19-10-3-4-11(15(7-10)20-2)9-5-13(16)12-8-17-18-14(12)6-9/h3-4,7-9,13H,5-6,16H2,1-2H3,(H,17,18)
InChIKeyAPDCQNAHPISFBL-UHFFFAOYSA-N
XLogP2.16
TPSA73.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(6S)-6-(2,4-dimethoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one
CID 40713699
3-(2,4-dimethoxyphenyl)cyclopentan-1-amine
CID 64503651
trans-(1S,2R)-2-(2,4-dimethoxyphenyl)cyclopropan-1-amine
CID 39238725
(4R)-7-methoxy-2-methyl-3,4-dihydro-2H-chromen-4-amine
CID 104944786
3-(2,4-dimethoxyphenyl)pyrrolidine;hydrochloride
CID 169498250
5-amino-6-(2,4-dimethoxyphenyl)piperidin-2-one
CID 64541230
5-(2,4-dimethoxyphenyl)-2-(hydroxymethylidene)cyclohexane-1,3-dione
CID 146459311
cis-(3R,5S)-3-[(4-amino-1,2,5-oxadiazol-3-yl)amino]-5-(2,4-dimethoxyphenyl)cyclohexan-1-one
CID 28503922
8-(2,4-dimethoxyphenyl)-3-methoxybicyclo[4.2.0]octa-1(6),2,4-triene
CID 54445831
(6R)-6-(4-methoxyphenyl)-1,5,6,7-tetrahydroindazol-4-one
CID 7306559
(3S,4S)-4-(2,4-dimethoxyphenyl)-1-methylpyrrolidin-3-amine
CID 96594536
(4R)-7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-amine
CID 104944809

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine?
The IUPAC name of 6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine (CID 66489467) is 6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine.
What is the SMILES notation for 6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine?
The canonical SMILES for 6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine is COc1ccc(C2Cc3[nH]ncc3C(N)C2)c(OC)c1.
What is the InChIKey of 6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine?
The InChIKey is APDCQNAHPISFBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-19-10-3-4-11(15(7-10)20-2)9-5-13(16)12-8-17-18-14(12)6-9/h3-4,7-9,13H,5-6,16H2,1-2H3,(H,17,18).
What are the key properties of 6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine?
6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine has a molecular weight of 273.34 g/mol, XLogP of 2.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indazol-4-amine is sourced from PubChem (CID 66489467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).