N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine

C11H19N3 — CID 130971947

IUPACN-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine
SMILESCC(C1CC1(C)C)N(C)c1ncc[nH]1
InChIInChI=1S/C11H19N3/c1-8(9-7-11(9,2)3)14(4)10-12-5-6-13-10/h5-6,8-9H,7H2,1-4H3,(H,12,13)
InChIKeyUIRNOCGUUTYCGT-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.28
Rot. Bonds3

About N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine

N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine (PubChem CID 130971947) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine
PubChem CID130971947
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine
SMILESCC(C1CC1(C)C)N(C)c1ncc[nH]1
InChIInChI=1S/C11H19N3/c1-8(9-7-11(9,2)3)14(4)10-12-5-6-13-10/h5-6,8-9H,7H2,1-4H3,(H,12,13)
InChIKeyUIRNOCGUUTYCGT-UHFFFAOYSA-N
XLogP2.28
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine?
The IUPAC name of N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine (CID 130971947) is N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine.
What is the SMILES notation for N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine?
The canonical SMILES for N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine is CC(C1CC1(C)C)N(C)c1ncc[nH]1.
What is the InChIKey of N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine?
The InChIKey is UIRNOCGUUTYCGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-8(9-7-11(9,2)3)14(4)10-12-5-6-13-10/h5-6,8-9H,7H2,1-4H3,(H,12,13).
What are the key properties of N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine?
N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,2-dimethylcyclopropyl)ethyl]-N-methyl-1H-imidazol-2-amine is sourced from PubChem (CID 130971947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).