N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine

C19H18ClN3O3 — CID 90787776

IUPACN-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
SMILESCOc1ccc(Nc2[nH][nH]c3c4cc(OC)c(OC)cc4cc2-3)cc1Cl
InChIInChI=1S/C19H18ClN3O3/c1-24-15-5-4-11(8-14(15)20)21-19-13-6-10-7-16(25-2)17(26-3)9-12(10)18(13)22-23-19/h4-9,21-23H,1-3H3
InChIKeyAVNGIAJELOZTKA-UHFFFAOYSA-N
MW371.82 g/mol
LogP5.02
Rot. Bonds5

About N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine

N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine (PubChem CID 90787776) has the molecular formula C19H18ClN3O3 and a molecular weight of 371.82 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
PubChem CID90787776
Molecular FormulaC19H18ClN3O3
Molecular Weight371.82 g/mol
Exact Mass371.10
IUPAC NameN-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
SMILESCOc1ccc(Nc2[nH][nH]c3c4cc(OC)c(OC)cc4cc2-3)cc1Cl
InChIInChI=1S/C19H18ClN3O3/c1-24-15-5-4-11(8-14(15)20)21-19-13-6-10-7-16(25-2)17(26-3)9-12(10)18(13)22-23-19/h4-9,21-23H,1-3H3
InChIKeyAVNGIAJELOZTKA-UHFFFAOYSA-N
XLogP5.02
TPSA71.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.82
LogP ≤ 55.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[3-(3-chloro-4-fluoroanilino)-7-methoxy-1,2-dihydroindeno[1,2-c]pyrazol-6-yl]oxy]propan-1-ol
CID 91155963
N-(2,4-dichlorophenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 90889419
6,7-dimethoxy-N-(3-propan-2-yloxyphenyl)-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 90836963
3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide
CID 91164733
ethyl 4-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzoate
CID 91022354
N-(2-bromophenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 91581818
N-(2,2-difluoro-1,3-benzodioxol-4-yl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 91489640
4-(3-chloro-4-methoxyanilino)phenol
CID 82537279
N-(3-chloro-4-methoxyphenyl)-2-(3,4-dimethoxyanilino)-1,3-thiazole-4-carboxamide
CID 16955474
N-(3-chloro-4-methoxyphenyl)-4,6-dimethylpyrimidin-2-amine
CID 734476
2-N-(3-chloro-4-methoxyphenyl)-4,5-dimethoxybenzene-1,2-diamine
CID 83004208
6-fluoro-N-(3-methoxyphenyl)-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 91392845

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine (CID 90787776) is N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine is COc1ccc(Nc2[nH][nH]c3c4cc(OC)c(OC)cc4cc2-3)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
The InChIKey is AVNGIAJELOZTKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O3/c1-24-15-5-4-11(8-14(15)20)21-19-13-6-10-7-16(25-2)17(26-3)9-12(10)18(13)22-23-19/h4-9,21-23H,1-3H3.
What are the key properties of N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine has a molecular weight of 371.82 g/mol, XLogP of 5.02, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine is sourced from PubChem (CID 90787776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).