1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine

C10H21N3 — CID 79510362

IUPAC1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine
SMILESCC(C)CCC1(C)CN=C(N)N1C
InChIInChI=1S/C10H21N3/c1-8(2)5-6-10(3)7-12-9(11)13(10)4/h8H,5-7H2,1-4H3,(H2,11,12)
InChIKeyLFYJCRZVYMSEGS-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.44
Rot. Bonds3

About 1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine

1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine (PubChem CID 79510362) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is 1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine.

Molecular Properties

Compound Name1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine
PubChem CID79510362
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine
SMILESCC(C)CCC1(C)CN=C(N)N1C
InChIInChI=1S/C10H21N3/c1-8(2)5-6-10(3)7-12-9(11)13(10)4/h8H,5-7H2,1-4H3,(H2,11,12)
InChIKeyLFYJCRZVYMSEGS-UHFFFAOYSA-N
XLogP1.44
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine?
The IUPAC name of 1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine (CID 79510362) is 1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine.
What is the SMILES notation for 1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine?
The canonical SMILES for 1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine is CC(C)CCC1(C)CN=C(N)N1C.
What is the InChIKey of 1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine?
The InChIKey is LFYJCRZVYMSEGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-8(2)5-6-10(3)7-12-9(11)13(10)4/h8H,5-7H2,1-4H3,(H2,11,12).
What are the key properties of 1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine?
1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine has a molecular weight of 183.30 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-5-(3-methylbutyl)-4H-imidazol-2-amine is sourced from PubChem (CID 79510362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).