N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine

C13H19N3 — CID 24804885

IUPACN-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCc1cccc(C(C)C)c1NC1=NCCN1
InChIInChI=1S/C13H19N3/c1-9(2)11-6-4-5-10(3)12(11)16-13-14-7-8-15-13/h4-6,9H,7-8H2,1-3H3,(H2,14,15,16)
InChIKeyHTIBGPWBCKDFNO-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.49
Rot. Bonds2

About N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine

N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 24804885) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID24804885
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC NameN-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCc1cccc(C(C)C)c1NC1=NCCN1
InChIInChI=1S/C13H19N3/c1-9(2)11-6-4-5-10(3)12(11)16-13-14-7-8-15-13/h4-6,9H,7-8H2,1-3H3,(H2,14,15,16)
InChIKeyHTIBGPWBCKDFNO-UHFFFAOYSA-N
XLogP2.49
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
CID 90678855
N-(2-bromo-3-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 86008018
N-(2,4,6-trimethylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 10354248
N-(4,5-dihydro-1H-imidazol-2-yl)-4-methyl-1H-indazol-3-amine;hydrochloride
CID 50994257
ethane;N-phenyl-4,5-dihydro-1H-imidazol-2-amine
CID 90984879
4-N-(2-methyl-6-propan-2-ylphenyl)benzene-1,4-diamine
CID 82292814
N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine
CID 117027081
N-(4,5-dihydro-1H-imidazol-2-yl)-7-propan-2-yl-1H-indol-5-amine
CID 15453460
N-(4-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride
CID 52949076
5-bromo-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine
CID 63463659
5-chloro-N-(2-methyl-6-propan-2-ylphenyl)pyridin-2-amine
CID 66234324
N-(5-methyl-8-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)-4,5-dihydro-1H-imidazol-2-amine
CID 58361125

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine (CID 24804885) is N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine is Cc1cccc(C(C)C)c1NC1=NCCN1.
What is the InChIKey of N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is HTIBGPWBCKDFNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-9(2)11-6-4-5-10(3)12(11)16-13-14-7-8-15-13/h4-6,9H,7-8H2,1-3H3,(H2,14,15,16).
What are the key properties of N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine?
N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 217.32 g/mol, XLogP of 2.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 24804885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).