2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine

C11H19N3 — CID 82401668

IUPAC2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine
SMILESCCc1nc(C2(CCN)CC2)c(C)[nH]1
InChIInChI=1S/C11H19N3/c1-3-9-13-8(2)10(14-9)11(4-5-11)6-7-12/h3-7,12H2,1-2H3,(H,13,14)
InChIKeyYYTRWCMCALJOLT-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.66
Rot. Bonds4

About 2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine

2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine (PubChem CID 82401668) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine.

Molecular Properties

Compound Name2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine
PubChem CID82401668
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine
SMILESCCc1nc(C2(CCN)CC2)c(C)[nH]1
InChIInChI=1S/C11H19N3/c1-3-9-13-8(2)10(14-9)11(4-5-11)6-7-12/h3-7,12H2,1-2H3,(H,13,14)
InChIKeyYYTRWCMCALJOLT-UHFFFAOYSA-N
XLogP1.66
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine?
The IUPAC name of 2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine (CID 82401668) is 2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine.
What is the SMILES notation for 2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine?
The canonical SMILES for 2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine is CCc1nc(C2(CCN)CC2)c(C)[nH]1.
What is the InChIKey of 2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine?
The InChIKey is YYTRWCMCALJOLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-9-13-8(2)10(14-9)11(4-5-11)6-7-12/h3-7,12H2,1-2H3,(H,13,14).
What are the key properties of 2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine?
2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine has a molecular weight of 193.29 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-ethyl-5-methyl-1H-imidazol-4-yl)cyclopropyl]ethanamine is sourced from PubChem (CID 82401668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).