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

C22H25N3O3 — CID 91002891

IUPACN-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
SMILESCCOc1cccc(Nc2[nH][nH]c3c4cc(OC)c(OC)cc4c(CC)c2-3)c1
InChIInChI=1S/C22H25N3O3/c1-5-15-16-11-18(26-3)19(27-4)12-17(16)21-20(15)22(25-24-21)23-13-8-7-9-14(10-13)28-6-2/h7-12,23-25H,5-6H2,1-4H3
InChIKeyHLKKHDNSPSSTGG-UHFFFAOYSA-N
MW379.46 g/mol
LogP5.32
Rot. Bonds7

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

N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine (PubChem CID 91002891) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine.

Molecular Properties

Compound NameN-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
PubChem CID91002891
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC NameN-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
SMILESCCOc1cccc(Nc2[nH][nH]c3c4cc(OC)c(OC)cc4c(CC)c2-3)c1
InChIInChI=1S/C22H25N3O3/c1-5-15-16-11-18(26-3)19(27-4)12-17(16)21-20(15)22(25-24-21)23-13-8-7-9-14(10-13)28-6-2/h7-12,23-25H,5-6H2,1-4H3
InChIKeyHLKKHDNSPSSTGG-UHFFFAOYSA-N
XLogP5.32
TPSA71.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500379.46
LogP ≤ 55.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6,7-diethoxy-N-(3-methoxyphenyl)-4-methyl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 91148404
N-(3-chlorophenyl)-6,7-dimethoxy-4-propan-2-yl-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 91350988
2-N-(3,4-dimethoxyphenyl)-4-N-(3-ethoxyphenyl)-1,3,5-triazine-2,4-diamine
CID 23536406
6,7-dimethoxy-N-(3-propan-2-yloxyphenyl)-1,2-dihydroindeno[1,2-c]pyrazol-3-amine
CID 90836963
(4S)-N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,4-dihydroindeno[2,1-d]pyrazol-3-amine
CID 58824981
N'-(2,5-dimethoxyphenyl)-N-(3-ethoxyphenyl)ethane-1,2-diamine
CID 54807830
3-ethoxy-N-[(2-methoxyphenyl)methyl]aniline
CID 54800907
2,6-dichloro-N-(3-ethoxyphenyl)-4-fluoroaniline
CID 141222673
3-ethoxy-N-(3-methoxybutan-2-yl)aniline
CID 115917474
N-(3-ethoxyphenyl)hydroxylamine
CID 13347158
3-ethoxy-2-N-(3-ethoxyphenyl)benzene-1,2-diamine
CID 140989971
2-amino-N-(3-ethoxyphenyl)-6-methoxybenzamide
CID 81394304

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
The IUPAC name of N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine (CID 91002891) is N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine.
What is the SMILES notation for N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
The canonical SMILES for N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine is CCOc1cccc(Nc2[nH][nH]c3c4cc(OC)c(OC)cc4c(CC)c2-3)c1.
What is the InChIKey of N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
The InChIKey is HLKKHDNSPSSTGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O3/c1-5-15-16-11-18(26-3)19(27-4)12-17(16)21-20(15)22(25-24-21)23-13-8-7-9-14(10-13)28-6-2/h7-12,23-25H,5-6H2,1-4H3.
What are the key properties of N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine?
N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine has a molecular weight of 379.46 g/mol, XLogP of 5.32, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxyphenyl)-4-ethyl-6,7-dimethoxy-1,2-dihydroindeno[1,2-c]pyrazol-3-amine is sourced from PubChem (CID 91002891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).