N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine

C11H16N6 — CID 106579724

IUPACN-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine
SMILESCc1cn(CCn2ccnn2)c(NC2CC2)n1
InChIInChI=1S/C11H16N6/c1-9-8-16(6-7-17-5-4-12-15-17)11(13-9)14-10-2-3-10/h4-5,8,10H,2-3,6-7H2,1H3,(H,13,14)
InChIKeyITQNVVVABFDBKE-UHFFFAOYSA-N
MW232.29 g/mol
LogP1.06
Rot. Bonds5

About N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine

N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine (PubChem CID 106579724) has the molecular formula C11H16N6 and a molecular weight of 232.29 g/mol. Its IUPAC name is N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine
PubChem CID106579724
Molecular FormulaC11H16N6
Molecular Weight232.29 g/mol
Exact Mass232.14
IUPAC NameN-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine
SMILESCc1cn(CCn2ccnn2)c(NC2CC2)n1
InChIInChI=1S/C11H16N6/c1-9-8-16(6-7-17-5-4-12-15-17)11(13-9)14-10-2-3-10/h4-5,8,10H,2-3,6-7H2,1H3,(H,13,14)
InChIKeyITQNVVVABFDBKE-UHFFFAOYSA-N
XLogP1.06
TPSA60.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclopentyl-4-methyl-1-(2-pyrazol-1-ylethyl)imidazol-2-amine
CID 106568575
4-methyl-N-(3-methylcyclopentyl)-1-propylimidazol-2-amine
CID 106581853
N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106554952
N-cyclopentyl-4-methyl-1-(3-pyrazol-1-ylpropyl)imidazol-2-amine
CID 106579652
N-cyclooctyl-4-methyl-1-propylimidazol-2-amine
CID 106557173
N-cyclopropyl-1-[2-[ethyl(methyl)amino]ethyl]-4-methylimidazol-2-amine
CID 106570435
N-cyclopropyl-4-methyl-1-(2-methylpropyl)imidazol-2-amine
CID 106554938
1-(2-methoxyethyl)-4-methyl-N-(4-methylcyclohexyl)imidazol-2-amine
CID 106560145
N-(3,4-dimethylcyclohexyl)-4-methyl-1-propylimidazol-2-amine
CID 106574600
4-methyl-1-propyl-N-(thian-4-yl)imidazol-2-amine
CID 106582146
N-cyclopentyl-1-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106554862
N-cyclopropyl-4-methyl-1-(2-thiophen-2-ylethyl)imidazol-2-amine
CID 106559095

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine?
The IUPAC name of N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine (CID 106579724) is N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine.
What is the SMILES notation for N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine?
The canonical SMILES for N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine is Cc1cn(CCn2ccnn2)c(NC2CC2)n1.
What is the InChIKey of N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine?
The InChIKey is ITQNVVVABFDBKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6/c1-9-8-16(6-7-17-5-4-12-15-17)11(13-9)14-10-2-3-10/h4-5,8,10H,2-3,6-7H2,1H3,(H,13,14).
What are the key properties of N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine?
N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine has a molecular weight of 232.29 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-methyl-1-[2-(triazol-1-yl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106579724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).