N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride

C11H14ClN5 — CID 24882018

IUPACN-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride
SMILESCc1cccc2cnn(NC3=NCCN3)c12.Cl
InChIInChI=1S/C11H13N5.ClH/c1-8-3-2-4-9-7-14-16(10(8)9)15-11-12-5-6-13-11;/h2-4,7H,5-6H2,1H3,(H2,12,13,15);1H
InChIKeyRDGSWAQVTVCUHN-UHFFFAOYSA-N
MW251.72 g/mol
LogP1.27
Rot. Bonds1

About N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride

N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride (PubChem CID 24882018) has the molecular formula C11H14ClN5 and a molecular weight of 251.72 g/mol. Its IUPAC name is N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride.

Molecular Properties

Compound NameN-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride
PubChem CID24882018
Molecular FormulaC11H14ClN5
Molecular Weight251.72 g/mol
Exact Mass251.09
IUPAC NameN-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride
SMILESCc1cccc2cnn(NC3=NCCN3)c12.Cl
InChIInChI=1S/C11H13N5.ClH/c1-8-3-2-4-9-7-14-16(10(8)9)15-11-12-5-6-13-11;/h2-4,7H,5-6H2,1H3,(H2,12,13,15);1H
InChIKeyRDGSWAQVTVCUHN-UHFFFAOYSA-N
XLogP1.27
TPSA54.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.72
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Marsanidine
CID 24882007
1-[(Imidazolidin-2-yl)imino]-7-methylindazole hydrochloride
CID 24882019
7-Cl-Marsanidine
CID 53323136
1-(4,5-dihydro-1H-imidazol-2-ylmethyl)indazole;hydrochloride
CID 57391903
1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-7-methylindazole;hydrochloride
CID 57400569
1-(4,5-dihydro-1H-imidazol-2-ylmethyl)-5-methylindazole;dihydrochloride
CID 90664846
N-(4,5-dihydro-1H-imidazol-2-yl)-7-fluoroindazol-1-amine
CID 118717249
Marsanidine hydrochloride
CID 24882006
N-(4,5-dihydro-1H-imidazol-2-yl)-3-phenylindazol-1-amine;hydrochloride
CID 24882008
N-(4,5-dihydro-1H-imidazol-2-yl)-4-methylindazol-1-amine;hydrochloride
CID 24882010
5-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)indazol-1-amine;hydrochloride
CID 24882014
4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)indazol-1-amine;hydrochloride
CID 24882105

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride?
The IUPAC name of N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride (CID 24882018) is N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride.
What is the SMILES notation for N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride?
The canonical SMILES for N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride is Cc1cccc2cnn(NC3=NCCN3)c12.Cl.
What is the InChIKey of N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride?
The InChIKey is RDGSWAQVTVCUHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5.ClH/c1-8-3-2-4-9-7-14-16(10(8)9)15-11-12-5-6-13-11;/h2-4,7H,5-6H2,1H3,(H2,12,13,15);1H.
What are the key properties of N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride?
N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride has a molecular weight of 251.72 g/mol, XLogP of 1.27, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dihydro-1H-imidazol-2-yl)-7-methylindazol-1-amine;hydrochloride is sourced from PubChem (CID 24882018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).