3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide

C19H18N4O3 — CID 91164733

IUPAC3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide
SMILESCOc1cc2cc3c(Nc4cccc(C(N)=O)c4)[nH][nH]c-3c2cc1OC
InChIInChI=1S/C19H18N4O3/c1-25-15-8-11-7-14-17(13(11)9-16(15)26-2)22-23-19(14)21-12-5-3-4-10(6-12)18(20)24/h3-9,21-23H,1-2H3,(H2,20,24)
InChIKeyCBGCQMIHQDKBGI-UHFFFAOYSA-N
MW350.38 g/mol
LogP3.46
Rot. Bonds5

About 3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide

3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide (PubChem CID 91164733) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide.

Molecular Properties

Compound Name3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide
PubChem CID91164733
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide
SMILESCOc1cc2cc3c(Nc4cccc(C(N)=O)c4)[nH][nH]c-3c2cc1OC
InChIInChI=1S/C19H18N4O3/c1-25-15-8-11-7-14-17(13(11)9-16(15)26-2)22-23-19(14)21-12-5-3-4-10(6-12)18(20)24/h3-9,21-23H,1-2H3,(H2,20,24)
InChIKeyCBGCQMIHQDKBGI-UHFFFAOYSA-N
XLogP3.46
TPSA105.16 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 53.46
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

6,7-dimethoxy-N-(3-propan-2-yloxyphenyl)-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 90836963
ethyl 4-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzoate
CID 91022354
N-(3-chloro-4-methoxyphenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 90787776
N-(2-bromophenyl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 91581818
6-fluoro-N-(3-methoxyphenyl)-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 91392845
N-(2,2-difluoro-1,3-benzodioxol-4-yl)-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 91489640
3-(2,3,4-trimethoxyphenyl)benzamide
CID 174562773
3-amino-4-(3,4-dimethoxyanilino)benzamide
CID 43448410
1-[3-[[6-amino-2-(3,4-dimethoxyphenyl)pyrimidin-4-yl]amino]phenyl]ethanone
CID 53214686
3-[(4-methoxyphenyl)carbamoylamino]benzamide
CID 572736
3-(3-fluoro-4-methoxyphenyl)benzamide
CID 68818750
3,4-dimethoxy-N'-[3-(pyrimidin-2-ylamino)benzoyl]benzohydrazide
CID 31890706

Frequently Asked Questions

What is the IUPAC name of 3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide?
The IUPAC name of 3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide (CID 91164733) is 3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide.
What is the SMILES notation for 3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide?
The canonical SMILES for 3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide is COc1cc2cc3c(Nc4cccc(C(N)=O)c4)[nH][nH]c-3c2cc1OC.
What is the InChIKey of 3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide?
The InChIKey is CBGCQMIHQDKBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-25-15-8-11-7-14-17(13(11)9-16(15)26-2)22-23-19(14)21-12-5-3-4-10(6-12)18(20)24/h3-9,21-23H,1-2H3,(H2,20,24).
What are the key properties of 3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide?
3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide has a molecular weight of 350.38 g/mol, XLogP of 3.46, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-yl)amino]benzamide is sourced from PubChem (CID 91164733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).