N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride

C10H14ClN3 — CID 52949076

IUPACN-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
SMILESCc1ccc(NC2=NCCN2)cc1.Cl
InChIInChI=1S/C10H13N3.ClH/c1-8-2-4-9(5-3-8)13-10-11-6-7-12-10;/h2-5H,6-7H2,1H3,(H2,11,12,13);1H
InChIKeyRBGXXIXKTAHFNT-UHFFFAOYSA-N
MW211.70 g/mol
LogP1.79
Rot. Bonds1

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

N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride (PubChem CID 52949076) has the molecular formula C10H14ClN3 and a molecular weight of 211.70 g/mol. Its IUPAC name is N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride.

Molecular Properties

Compound NameN-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
PubChem CID52949076
Molecular FormulaC10H14ClN3
Molecular Weight211.70 g/mol
Exact Mass211.09
IUPAC NameN-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
SMILESCc1ccc(NC2=NCCN2)cc1.Cl
InChIInChI=1S/C10H13N3.ClH/c1-8-2-4-9(5-3-8)13-10-11-6-7-12-10;/h2-5H,6-7H2,1H3,(H2,11,12,13);1H
InChIKeyRBGXXIXKTAHFNT-UHFFFAOYSA-N
XLogP1.79
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.70
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;N-phenyl-4,5-dihydro-1H-imidazol-2-amine
CID 90984879
N-(4,5-dihydro-1H-imidazol-2-yl)-5-methylpyridin-2-amine;hydrochloride
CID 118730400
N-(3-fluoro-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 3088359
N-(3-bromo-4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 114400222
1-N,4-N-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,4-dicarboxamide;hydrochloride
CID 44531712
1-[4-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]phenyl]propan-1-one
CID 18470010
4-(4,5-dihydro-1H-imidazol-2-ylamino)benzamide
CID 22245999
N-(2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
CID 90678855
N-[4-[2-(4-aminophenyl)ethyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine
CID 44550829
N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 10354248
N-[(1R)-1-(4-methylphenyl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
CID 104921027
1-N,3-N-bis[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]benzene-1,3-dicarboxamide;dihydrochloride
CID 131880352

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The IUPAC name of N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride (CID 52949076) is N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride.
What is the SMILES notation for N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The canonical SMILES for N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride is Cc1ccc(NC2=NCCN2)cc1.Cl.
What is the InChIKey of N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
The InChIKey is RBGXXIXKTAHFNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3.ClH/c1-8-2-4-9(5-3-8)13-10-11-6-7-12-10;/h2-5H,6-7H2,1H3,(H2,11,12,13);1H.
What are the key properties of N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride?
N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride has a molecular weight of 211.70 g/mol, XLogP of 1.79, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride is sourced from PubChem (CID 52949076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).