5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride

C14H20ClN3 — CID 90644727

IUPAC5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
SMILESCC1CN=C(Nc2ccc3c(c2)CCCC3)N1.Cl
InChIInChI=1S/C14H19N3.ClH/c1-10-9-15-14(16-10)17-13-7-6-11-4-2-3-5-12(11)8-13;/h6-8,10H,2-5,9H2,1H3,(H2,15,16,17);1H
InChIKeyZAGJVWVJTZWYPQ-UHFFFAOYSA-N
MW265.79 g/mol
LogP2.75
Rot. Bonds1

About 5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride

5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride (PubChem CID 90644727) has the molecular formula C14H20ClN3 and a molecular weight of 265.79 g/mol. Its IUPAC name is 5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride.

Molecular Properties

Compound Name5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
PubChem CID90644727
Molecular FormulaC14H20ClN3
Molecular Weight265.79 g/mol
Exact Mass265.13
IUPAC Name5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
SMILESCC1CN=C(Nc2ccc3c(c2)CCCC3)N1.Cl
InChIInChI=1S/C14H19N3.ClH/c1-10-9-15-14(16-10)17-13-7-6-11-4-2-3-5-12(11)8-13;/h6-8,10H,2-5,9H2,1H3,(H2,15,16,17);1H
InChIKeyZAGJVWVJTZWYPQ-UHFFFAOYSA-N
XLogP2.75
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.79
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The IUPAC name of 5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride (CID 90644727) is 5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride.
What is the SMILES notation for 5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The canonical SMILES for 5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride is CC1CN=C(Nc2ccc3c(c2)CCCC3)N1.Cl.
What is the InChIKey of 5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The InChIKey is ZAGJVWVJTZWYPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3.ClH/c1-10-9-15-14(16-10)17-13-7-6-11-4-2-3-5-12(11)8-13;/h6-8,10H,2-5,9H2,1H3,(H2,15,16,17);1H.
What are the key properties of 5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride has a molecular weight of 265.79 g/mol, XLogP of 2.75, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(5,6,7,8-tetrahydronaphthalen-2-yl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride is sourced from PubChem (CID 90644727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).