N,5-dimethyl-1H-indol-2-amine;dihydrochloride

C10H14Cl2N2 — CID 57435942

IUPACN,5-dimethyl-1H-indol-2-amine;dihydrochloride
SMILESCNc1cc2cc(C)ccc2[nH]1.Cl.Cl
InChIInChI=1S/C10H12N2.2ClH/c1-7-3-4-9-8(5-7)6-10(11-2)12-9;;/h3-6,11-12H,1-2H3;2*1H
InChIKeyFNNWEHZGFLTFFV-UHFFFAOYSA-N
MW233.14 g/mol
LogP3.36
Rot. Bonds1

About N,5-dimethyl-1H-indol-2-amine;dihydrochloride

N,5-dimethyl-1H-indol-2-amine;dihydrochloride (PubChem CID 57435942) has the molecular formula C10H14Cl2N2 and a molecular weight of 233.14 g/mol. Its IUPAC name is N,5-dimethyl-1H-indol-2-amine;dihydrochloride.

Molecular Properties

Compound NameN,5-dimethyl-1H-indol-2-amine;dihydrochloride
PubChem CID57435942
Molecular FormulaC10H14Cl2N2
Molecular Weight233.14 g/mol
Exact Mass232.05
IUPAC NameN,5-dimethyl-1H-indol-2-amine;dihydrochloride
SMILESCNc1cc2cc(C)ccc2[nH]1.Cl.Cl
InChIInChI=1S/C10H12N2.2ClH/c1-7-3-4-9-8(5-7)6-10(11-2)12-9;;/h3-6,11-12H,1-2H3;2*1H
InChIKeyFNNWEHZGFLTFFV-UHFFFAOYSA-N
XLogP3.36
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.14
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-2-(trifluoromethyl)-1H-indole
CID 83485208
2-methanidyl-5-methyl-1H-indole;yttrium
CID 59004658
2,5-dimethyl-1H-indole;ethane;propane
CID 144992538
2-(methylamino)-1-(5-methyl-1H-indol-2-yl)ethanone
CID 82397100
2-(5-methyl-1H-indol-2-yl)ethanol
CID 83674310
2-[(2R)-aziridin-2-yl]-5-methyl-1H-indole
CID 55263404
1-(5-methyl-1H-indol-2-yl)cyclopropan-1-amine
CID 82405741
N,2-dimethyl-1H-indol-5-amine
CID 12537594
2-(2,4-dichlorophenyl)-5-methyl-1H-indole
CID 131886780
2-(5-chlorothiophen-2-yl)-5-methyl-1H-indole
CID 131886787
3-(5-methyl-1H-indol-2-yl)-3-oxopropanoic acid
CID 165356574
N-[(5-methyl-1H-indol-2-yl)methylidene]hydroxylamine
CID 137199836

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-1H-indol-2-amine;dihydrochloride?
The IUPAC name of N,5-dimethyl-1H-indol-2-amine;dihydrochloride (CID 57435942) is N,5-dimethyl-1H-indol-2-amine;dihydrochloride.
What is the SMILES notation for N,5-dimethyl-1H-indol-2-amine;dihydrochloride?
The canonical SMILES for N,5-dimethyl-1H-indol-2-amine;dihydrochloride is CNc1cc2cc(C)ccc2[nH]1.Cl.Cl.
What is the InChIKey of N,5-dimethyl-1H-indol-2-amine;dihydrochloride?
The InChIKey is FNNWEHZGFLTFFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2.2ClH/c1-7-3-4-9-8(5-7)6-10(11-2)12-9;;/h3-6,11-12H,1-2H3;2*1H.
What are the key properties of N,5-dimethyl-1H-indol-2-amine;dihydrochloride?
N,5-dimethyl-1H-indol-2-amine;dihydrochloride has a molecular weight of 233.14 g/mol, XLogP of 3.36, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-1H-indol-2-amine;dihydrochloride is sourced from PubChem (CID 57435942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).