1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine

C13H23N3 — CID 63912643

IUPAC1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine
SMILESCCNC(Cn1ccnc1C(C)C)C1CC1
InChIInChI=1S/C13H23N3/c1-4-14-12(11-5-6-11)9-16-8-7-15-13(16)10(2)3/h7-8,10-12,14H,4-6,9H2,1-3H3
InChIKeyORXDWCWLBKRKMG-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.39
Rot. Bonds6

About 1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine

1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine (PubChem CID 63912643) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine
PubChem CID63912643
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine
SMILESCCNC(Cn1ccnc1C(C)C)C1CC1
InChIInChI=1S/C13H23N3/c1-4-14-12(11-5-6-11)9-16-8-7-15-13(16)10(2)3/h7-8,10-12,14H,4-6,9H2,1-3H3
InChIKeyORXDWCWLBKRKMG-UHFFFAOYSA-N
XLogP2.39
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-cyclohexyl-2-(2-propan-2-ylimidazol-1-yl)ethyl]propan-1-amine
CID 104747255
N-ethyl-2-(1-ethylimidazol-2-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 79751359
1-[2-cyclopropyl-2-(ethylamino)ethyl]pyrimidin-2-one
CID 63915013
N-ethyl-1-methoxy-3-(2-propan-2-ylimidazol-1-yl)propan-2-amine
CID 107506086
1-cyclopropyl-N-ethyl-4-(1-ethylimidazol-2-yl)butan-1-amine
CID 79762173
N-[1-cyclopropyl-2-(2-methylimidazol-1-yl)ethyl]propan-1-amine
CID 63912853
1-cyclopropyl-2-(4,5-dimethylimidazol-1-yl)-N-ethylethanamine
CID 63913754
N-[1-cyclopentyl-2-(2-propylimidazol-1-yl)ethyl]propan-1-amine
CID 104747735
3-cyclopropyl-N-ethyl-1-(1-ethylimidazol-2-yl)butan-2-amine
CID 105009226
(2S)-1-(2-propan-2-ylimidazol-1-yl)propan-2-amine
CID 28794327
N-ethyl-1-(3-ethylcyclopentyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 79761771
methyl 2-methyl-3-(2-propan-2-ylimidazol-1-yl)propanoate
CID 43538211

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine?
The IUPAC name of 1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine (CID 63912643) is 1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine?
The canonical SMILES for 1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine is CCNC(Cn1ccnc1C(C)C)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine?
The InChIKey is ORXDWCWLBKRKMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-4-14-12(11-5-6-11)9-16-8-7-15-13(16)10(2)3/h7-8,10-12,14H,4-6,9H2,1-3H3.
What are the key properties of 1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine?
1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine has a molecular weight of 221.35 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-ethyl-2-(2-propan-2-ylimidazol-1-yl)ethanamine is sourced from PubChem (CID 63912643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).