4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine

C10H20N4 — CID 62506448

IUPAC4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine
SMILESCC(C)Cc1nc(C(C)C)n(N)c1N
InChIInChI=1S/C10H20N4/c1-6(2)5-8-9(11)14(12)10(13-8)7(3)4/h6-7H,5,11-12H2,1-4H3
InChIKeyZMTPYFIBFWCJSB-UHFFFAOYSA-N
MW196.30 g/mol
LogP1.50
Rot. Bonds3

About 4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine

4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine (PubChem CID 62506448) has the molecular formula C10H20N4 and a molecular weight of 196.30 g/mol. Its IUPAC name is 4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine.

Molecular Properties

Compound Name4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine
PubChem CID62506448
Molecular FormulaC10H20N4
Molecular Weight196.30 g/mol
Exact Mass196.17
IUPAC Name4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine
SMILESCC(C)Cc1nc(C(C)C)n(N)c1N
InChIInChI=1S/C10H20N4/c1-6(2)5-8-9(11)14(12)10(13-8)7(3)4/h6-7H,5,11-12H2,1-4H3
InChIKeyZMTPYFIBFWCJSB-UHFFFAOYSA-N
XLogP1.50
TPSA69.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.30
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine?
The IUPAC name of 4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine (CID 62506448) is 4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine.
What is the SMILES notation for 4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine?
The canonical SMILES for 4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine is CC(C)Cc1nc(C(C)C)n(N)c1N.
What is the InChIKey of 4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine?
The InChIKey is ZMTPYFIBFWCJSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4/c1-6(2)5-8-9(11)14(12)10(13-8)7(3)4/h6-7H,5,11-12H2,1-4H3.
What are the key properties of 4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine?
4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine has a molecular weight of 196.30 g/mol, XLogP of 1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropyl)-2-propan-2-ylimidazole-1,5-diamine is sourced from PubChem (CID 62506448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).