N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine

C10H13N3S — CID 11390143

IUPACN-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCSc1ccc(NC2=NCCN2)cc1
InChIInChI=1S/C10H13N3S/c1-14-9-4-2-8(3-5-9)13-10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H2,11,12,13)
InChIKeyRHTGPDGIQRRWHO-UHFFFAOYSA-N
MW207.30 g/mol
LogP1.78
Rot. Bonds2

About N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine

N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 11390143) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID11390143
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC NameN-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCSc1ccc(NC2=NCCN2)cc1
InChIInChI=1S/C10H13N3S/c1-14-9-4-2-8(3-5-9)13-10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H2,11,12,13)
InChIKeyRHTGPDGIQRRWHO-UHFFFAOYSA-N
XLogP1.78
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Methiotriazamine
CID 22401
N-(4,5-Dihydro-1H-imidazol-2-ylmethyl)-2-(methylthio)aniline
CID 11108001
N-[4-[4-(4,5-dihydro-1H-imidazol-2-ylamino)phenyl]sulfanylphenyl]methanesulfonamide
CID 11175906
1H-Imidazol-2-amine, N-[4-[(4-chlorophenyl)thio]phenyl]-4,5-dihydro-
CID 11243628
1H-Imidazol-2-amine, 4,5-dihydro-N-[4-[(4-nitrophenyl)thio]phenyl]-
CID 11255468
1H-Imidazol-2-amine, 4,5-dihydro-N-[4-(phenylthio)phenyl]-
CID 11391560
1H-Imidazol-2-amine, 4,5-dihydro-N-[4-[(4-methylphenyl)thio]phenyl]-
CID 11414893
4-N-(4,5-dihydro-1H-imidazol-2-yl)-1-N-methylbenzene-1,4-diamine
CID 25209507
N-phenyl-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
CID 52942945
Imidazolidine, 2-(phenylimino)-
CID 137235
N-[4-Fluoro-2-(methylthio)phenyl]-4,5-dihydro-1H-imidazole-2-methanamine
CID 11097789
N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-3-fluoro-2-methylsulfanylaniline
CID 11140345

Frequently Asked Questions

What is the IUPAC name of N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine (CID 11390143) is N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine is CSc1ccc(NC2=NCCN2)cc1.
What is the InChIKey of N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is RHTGPDGIQRRWHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-14-9-4-2-8(3-5-9)13-10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H2,11,12,13).
What are the key properties of N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 207.30 g/mol, XLogP of 1.78, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylsulfanylphenyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 11390143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).