7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride

C17H18Cl3N3 — CID 172740552

IUPAC7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride
SMILESCCCNc1c2cccc(-c3ccc(Cl)cc3Cl)c2nn1C.Cl
InChIInChI=1S/C17H17Cl2N3.ClH/c1-3-9-20-17-14-6-4-5-13(16(14)21-22(17)2)12-8-7-11(18)10-15(12)19;/h4-8,10,20H,3,9H2,1-2H3;1H
InChIKeyJAPVFTMNEMQADP-UHFFFAOYSA-N
MW370.71 g/mol
LogP5.79
Rot. Bonds4

About 7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride

7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride (PubChem CID 172740552) has the molecular formula C17H18Cl3N3 and a molecular weight of 370.71 g/mol. Its IUPAC name is 7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride.

Molecular Properties

Compound Name7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride
PubChem CID172740552
Molecular FormulaC17H18Cl3N3
Molecular Weight370.71 g/mol
Exact Mass369.06
IUPAC Name7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride
SMILESCCCNc1c2cccc(-c3ccc(Cl)cc3Cl)c2nn1C.Cl
InChIInChI=1S/C17H17Cl2N3.ClH/c1-3-9-20-17-14-6-4-5-13(16(14)21-22(17)2)12-8-7-11(18)10-15(12)19;/h4-8,10,20H,3,9H2,1-2H3;1H
InChIKeyJAPVFTMNEMQADP-UHFFFAOYSA-N
XLogP5.79
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.71
LogP ≤ 55.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[7-(2,4-dichlorophenyl)-2-methylindazol-3-yl]urea
CID 68615025
7-(2,4-dichlorophenyl)-3-ethynyl-2-methylindazole
CID 59702308
7-(2,4-dichlorophenyl)-2-methylindazole-3-carbonitrile
CID 59702374
[7-(2,4-dichlorophenyl)-2-methylindazol-3-yl] methyl carbonate
CID 68614157
N-[7-(2,4-dichlorophenyl)-2-methylindazol-3-yl]-N'-(3,3-dimethoxypropyl)methanimidamide
CID 58988252
1-[7-(2,4-dichlorophenyl)-2-methylindazol-3-yl]pyrrole-2,5-diol
CID 91469465
ethyl 2-[7-(2,4-dichlorophenyl)-2-methylindazol-3-yl]ethanimidate
CID 58988264
7-bromo-2-methylindazole-3-carbaldehyde;7-(2,4-dichlorophenyl)-2-methylindazole-3-carbaldehyde
CID 157157508
4-[[7-(2,4-dichlorophenyl)-2-methylindazol-3-yl]methyl]morpholine
CID 21094603
2-[7-(2,4-dichlorophenyl)-2-methylindazol-3-yl]-1,3,4-oxadiazole
CID 58988236
2-[[7-(2,4-dichlorophenyl)-2-methylindazol-3-yl]methyl-(methylamino)amino]-2-iminoacetamide
CID 89328212
1-[7-(2,4-dichlorophenyl)-2-methylindazol-3-yl]-N-[(Z)-prop-1-enyl]propan-2-imine
CID 89129673

Frequently Asked Questions

What is the IUPAC name of 7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride?
The IUPAC name of 7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride (CID 172740552) is 7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride.
What is the SMILES notation for 7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride?
The canonical SMILES for 7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride is CCCNc1c2cccc(-c3ccc(Cl)cc3Cl)c2nn1C.Cl.
What is the InChIKey of 7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride?
The InChIKey is JAPVFTMNEMQADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Cl2N3.ClH/c1-3-9-20-17-14-6-4-5-13(16(14)21-22(17)2)12-8-7-11(18)10-15(12)19;/h4-8,10,20H,3,9H2,1-2H3;1H.
What are the key properties of 7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride?
7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride has a molecular weight of 370.71 g/mol, XLogP of 5.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,4-dichlorophenyl)-2-methyl-N-propylindazol-3-amine;hydrochloride is sourced from PubChem (CID 172740552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).