1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine

C8H14N4 — CID 62136968

IUPAC1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine
SMILESCCn1ccnc1NC1CC1N
InChIInChI=1S/C8H14N4/c1-2-12-4-3-10-8(12)11-7-5-6(7)9/h3-4,6-7H,2,5,9H2,1H3,(H,10,11)
InChIKeyRXFLOJAJXHRSOY-UHFFFAOYSA-N
MW166.23 g/mol
LogP0.41
Rot. Bonds3

About 1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine

1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine (PubChem CID 62136968) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine.

Molecular Properties

Compound Name1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine
PubChem CID62136968
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine
SMILESCCn1ccnc1NC1CC1N
InChIInChI=1S/C8H14N4/c1-2-12-4-3-10-8(12)11-7-5-6(7)9/h3-4,6-7H,2,5,9H2,1H3,(H,10,11)
InChIKeyRXFLOJAJXHRSOY-UHFFFAOYSA-N
XLogP0.41
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chlorocyclohexyl)-1-ethylimidazol-2-amine
CID 65029087
1-ethyl-N-(3-ethylcyclohexyl)imidazol-2-amine
CID 64742243
4-[(1-ethylimidazol-2-yl)amino]oxolane-3-carboxylic acid
CID 66240502
N-(1-cyclopropylethyl)-1-ethylimidazol-2-amine
CID 62136953
N-(1-ethylimidazol-2-yl)-2,6-dimethylpiperidin-1-amine
CID 83026249
1-ethyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]imidazol-2-amine
CID 62137313
1-(3-methoxypropyl)-N-(2-methylcyclopropyl)imidazol-2-amine
CID 106571163
N-(1-ethylimidazol-2-yl)-2,2-dimethylpentane-1,5-diamine
CID 106142947
N-(3-methylcyclopentyl)-1-propylimidazol-2-amine
CID 106581825
3-[(1-ethylimidazol-2-yl)amino]-2,2-dimethylpropan-1-ol
CID 115360823
2-[(1-ethylimidazol-2-yl)methyl]cyclobutan-1-amine
CID 81014583
1-ethyl-N-[(1-methylpyrazol-4-yl)methyl]imidazol-2-amine
CID 62136959

Frequently Asked Questions

What is the IUPAC name of 1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine?
The IUPAC name of 1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine (CID 62136968) is 1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine.
What is the SMILES notation for 1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine?
The canonical SMILES for 1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine is CCn1ccnc1NC1CC1N.
What is the InChIKey of 1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine?
The InChIKey is RXFLOJAJXHRSOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-2-12-4-3-10-8(12)11-7-5-6(7)9/h3-4,6-7H,2,5,9H2,1H3,(H,10,11).
What are the key properties of 1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine?
1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine has a molecular weight of 166.23 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(1-ethylimidazol-2-yl)cyclopropane-1,2-diamine is sourced from PubChem (CID 62136968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).