5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine

C9H15N5 — CID 79509780

IUPAC5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCC(C)n1cncc1C1CN=C(N)N1
InChIInChI=1S/C9H15N5/c1-6(2)14-5-11-4-8(14)7-3-12-9(10)13-7/h4-7H,3H2,1-2H3,(H3,10,12,13)
InChIKeyLLONPBKGASMEGN-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.42
Rot. Bonds2

About 5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine

5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 79509780) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID79509780
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC Name5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCC(C)n1cncc1C1CN=C(N)N1
InChIInChI=1S/C9H15N5/c1-6(2)14-5-11-4-8(14)7-3-12-9(10)13-7/h4-7H,3H2,1-2H3,(H3,10,12,13)
InChIKeyLLONPBKGASMEGN-UHFFFAOYSA-N
XLogP0.42
TPSA68.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-propan-2-ylimidazol-4-yl)oxolan-3-amine
CID 79365132
2-(3-propan-2-ylimidazol-4-yl)-1,3-thiazinane
CID 66217524
5-[2-(chloromethyl)cyclopropyl]-1-propan-2-ylimidazole
CID 81358333
5-(3-methylpyrrolidin-2-yl)-1-propan-2-ylimidazole
CID 66162395
[2-(3-propan-2-ylimidazol-4-yl)oxolan-3-yl]methanamine
CID 79368224
5-(3-propan-2-ylimidazol-4-yl)cyclohexane-1,3-dione
CID 81341194
1-(3-bromophenyl)-5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydroimidazol-2-amine
CID 79502490
2-(3-propan-2-ylimidazol-4-yl)-1-propylpyrrolidin-3-amine
CID 66163186
[1-cyclopropyl-2-(3-propan-2-ylimidazol-4-yl)pyrrolidin-3-yl]methanamine
CID 66163581
1-(2-methylpropyl)-2-(3-propan-2-ylimidazol-4-yl)piperidin-3-amine
CID 66162586
1-ethyl-2-(3-propan-2-ylimidazol-4-yl)azepan-3-amine
CID 66163787
1-(5-cyclopropylimidazol-1-yl)ethanethiol
CID 147733505

Frequently Asked Questions

What is the IUPAC name of 5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of 5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine (CID 79509780) is 5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for 5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for 5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine is CC(C)n1cncc1C1CN=C(N)N1.
What is the InChIKey of 5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is LLONPBKGASMEGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5/c1-6(2)14-5-11-4-8(14)7-3-12-9(10)13-7/h4-7H,3H2,1-2H3,(H3,10,12,13).
What are the key properties of 5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine?
5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 193.25 g/mol, XLogP of 0.42, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-propan-2-ylimidazol-4-yl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 79509780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).