2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine

C11H23N3 — CID 118227678

IUPAC2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine
SMILESCN1C=CN(C(C)(C)CC(C)(C)N)C1
InChIInChI=1S/C11H23N3/c1-10(2,12)8-11(3,4)14-7-6-13(5)9-14/h6-7H,8-9,12H2,1-5H3
InChIKeyZXZZYSWZIXAPFQ-UHFFFAOYSA-N
MW197.33 g/mol
LogP1.57
Rot. Bonds3

About 2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine

2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine (PubChem CID 118227678) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine.

Molecular Properties

Compound Name2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine
PubChem CID118227678
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine
SMILESCN1C=CN(C(C)(C)CC(C)(C)N)C1
InChIInChI=1S/C11H23N3/c1-10(2,12)8-11(3,4)14-7-6-13(5)9-14/h6-7H,8-9,12H2,1-5H3
InChIKeyZXZZYSWZIXAPFQ-UHFFFAOYSA-N
XLogP1.57
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-Methylpentan-2-yl)-1,2-dihydroimidazole
CID 137395376
(2R)-2-[3-(2-methylbut-3-yn-2-yl)-2H-imidazol-1-yl]pentan-2-amine
CID 166753757
1-methyl-3-(2-methylpentan-2-yl)-2H-imidazole
CID 176267310

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine?
The IUPAC name of 2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine (CID 118227678) is 2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine.
What is the SMILES notation for 2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine?
The canonical SMILES for 2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine is CN1C=CN(C(C)(C)CC(C)(C)N)C1.
What is the InChIKey of 2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine?
The InChIKey is ZXZZYSWZIXAPFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-10(2,12)8-11(3,4)14-7-6-13(5)9-14/h6-7H,8-9,12H2,1-5H3.
What are the key properties of 2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine?
2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine has a molecular weight of 197.33 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-4-(3-methyl-2H-imidazol-1-yl)pentan-2-amine is sourced from PubChem (CID 118227678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).