N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine

C10H16N6 — CID 106572865

IUPACN-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine
SMILESCCNc1nccn1CCc1nncn1C
InChIInChI=1S/C10H16N6/c1-3-11-10-12-5-7-16(10)6-4-9-14-13-8-15(9)2/h5,7-8H,3-4,6H2,1-2H3,(H,11,12)
InChIKeyLYTRZWZFUOAHJY-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.69
Rot. Bonds5

About N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine

N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine (PubChem CID 106572865) has the molecular formula C10H16N6 and a molecular weight of 220.28 g/mol. Its IUPAC name is N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine.

Molecular Properties

Compound NameN-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine
PubChem CID106572865
Molecular FormulaC10H16N6
Molecular Weight220.28 g/mol
Exact Mass220.14
IUPAC NameN-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine
SMILESCCNc1nccn1CCc1nncn1C
InChIInChI=1S/C10H16N6/c1-3-11-10-12-5-7-16(10)6-4-9-14-13-8-15(9)2/h5,7-8H,3-4,6H2,1-2H3,(H,11,12)
InChIKeyLYTRZWZFUOAHJY-UHFFFAOYSA-N
XLogP0.69
TPSA60.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine
CID 106569980
N-ethyl-1-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine
CID 106577202
1-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine
CID 62133277
1-(2-methylpropyl)-3-[2-(4-methyl-1,2,4-triazol-3-yl)ethylamino]pyrazin-2-one
CID 63330276
N-ethyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine
CID 106567554
1-(2-cyclopropylethyl)-N-ethylimidazol-2-amine
CID 106575831
1-(2-cyclopentylethyl)-N-ethylimidazol-2-amine
CID 106563426
N-ethyl-1-(4-methoxybutyl)imidazol-2-amine
CID 106565023
2-N-ethyl-4-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]pyrimidine-2,4-diamine
CID 80830333
N-ethyl-1-(3-phenylbutyl)imidazol-2-amine
CID 106572158
N-ethyl-1-[2-(2-methoxyethoxy)ethyl]imidazol-2-amine
CID 106564453
N-(3-methoxypropyl)-1-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
CID 106568485

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine?
The IUPAC name of N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine (CID 106572865) is N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine.
What is the SMILES notation for N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine?
The canonical SMILES for N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine is CCNc1nccn1CCc1nncn1C.
What is the InChIKey of N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine?
The InChIKey is LYTRZWZFUOAHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N6/c1-3-11-10-12-5-7-16(10)6-4-9-14-13-8-15(9)2/h5,7-8H,3-4,6H2,1-2H3,(H,11,12).
What are the key properties of N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine?
N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine has a molecular weight of 220.28 g/mol, XLogP of 0.69, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106572865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).