N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine

C12H23N3 — CID 15633074

IUPACN,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine
SMILESCCC(CC)C1=NC(C)(C)C(N(C)C)=N1
InChIInChI=1S/C12H23N3/c1-7-9(8-2)10-13-11(15(5)6)12(3,4)14-10/h9H,7-8H2,1-6H3
InChIKeyRARXHDZNCHMGKI-UHFFFAOYSA-N
MW209.34 g/mol
LogP2.57
Rot. Bonds3

About N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine

N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine (PubChem CID 15633074) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine.

Molecular Properties

Compound NameN,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine
PubChem CID15633074
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC NameN,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine
SMILESCCC(CC)C1=NC(C)(C)C(N(C)C)=N1
InChIInChI=1S/C12H23N3/c1-7-9(8-2)10-13-11(15(5)6)12(3,4)14-10/h9H,7-8H2,1-6H3
InChIKeyRARXHDZNCHMGKI-UHFFFAOYSA-N
XLogP2.57
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine?
The IUPAC name of N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine (CID 15633074) is N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine.
What is the SMILES notation for N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine?
The canonical SMILES for N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine is CCC(CC)C1=NC(C)(C)C(N(C)C)=N1.
What is the InChIKey of N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine?
The InChIKey is RARXHDZNCHMGKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-7-9(8-2)10-13-11(15(5)6)12(3,4)14-10/h9H,7-8H2,1-6H3.
What are the key properties of N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine?
N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine has a molecular weight of 209.34 g/mol, XLogP of 2.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,5,5-tetramethyl-2-pentan-3-ylimidazol-4-amine is sourced from PubChem (CID 15633074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).