(2R)-1-(1-ethylimidazol-2-yl)propan-2-amine

C8H15N3 — CID 92763393

IUPAC(2R)-1-(1-ethylimidazol-2-yl)propan-2-amine
SMILESCCn1ccnc1C[C@@H](C)N
InChIInChI=1S/C8H15N3/c1-3-11-5-4-10-8(11)6-7(2)9/h4-5,7H,3,6,9H2,1-2H3/t7-/m1/s1
InChIKeyISGLLAYBDAHTIS-SSDOTTSWSA-N
MW153.23 g/mol
LogP0.79
Rot. Bonds3

About (2R)-1-(1-ethylimidazol-2-yl)propan-2-amine

(2R)-1-(1-ethylimidazol-2-yl)propan-2-amine (PubChem CID 92763393) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is (2R)-1-(1-ethylimidazol-2-yl)propan-2-amine.

Molecular Properties

Compound Name(2R)-1-(1-ethylimidazol-2-yl)propan-2-amine
PubChem CID92763393
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name(2R)-1-(1-ethylimidazol-2-yl)propan-2-amine
SMILESCCn1ccnc1C[C@@H](C)N
InChIInChI=1S/C8H15N3/c1-3-11-5-4-10-8(11)6-7(2)9/h4-5,7H,3,6,9H2,1-2H3/t7-/m1/s1
InChIKeyISGLLAYBDAHTIS-SSDOTTSWSA-N
XLogP0.79
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-octylimidazol-2-yl)propan-2-amine
CID 63096350
1-(1-ethylimidazol-2-yl)-3-(2-methylpropylsulfanyl)propan-2-amine
CID 79760461
1-(1-ethylimidazol-2-yl)undecan-2-amine
CID 105009322
1-(1-ethylimidazol-2-yl)-3-methylpentan-2-ol
CID 79744876
3-(1-ethylimidazol-2-yl)-N,2-dimethylpropan-1-amine
CID 64666437
[1-(1-ethylimidazol-2-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine
CID 105226285
[3-ethyl-1-(1-ethylimidazol-2-yl)pentan-2-yl]hydrazine
CID 105321751
1-(2,2-dimethylcyclopropyl)-2-(1-ethylimidazol-2-yl)ethanamine
CID 107004731
1-(1-ethylimidazol-2-yl)ethanamine
CID 63970415
2-(1-ethylimidazol-2-yl)-1-(2-methylphenyl)ethanamine
CID 79751911
5-(1-ethylimidazol-2-yl)-4-methylpentan-2-one
CID 79760691
1-[1-[3-(2,2,2-trifluoroethoxy)propyl]imidazol-2-yl]propan-2-amine
CID 55181651

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(1-ethylimidazol-2-yl)propan-2-amine?
The IUPAC name of (2R)-1-(1-ethylimidazol-2-yl)propan-2-amine (CID 92763393) is (2R)-1-(1-ethylimidazol-2-yl)propan-2-amine.
What is the SMILES notation for (2R)-1-(1-ethylimidazol-2-yl)propan-2-amine?
The canonical SMILES for (2R)-1-(1-ethylimidazol-2-yl)propan-2-amine is CCn1ccnc1C[C@@H](C)N.
What is the InChIKey of (2R)-1-(1-ethylimidazol-2-yl)propan-2-amine?
The InChIKey is ISGLLAYBDAHTIS-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H15N3/c1-3-11-5-4-10-8(11)6-7(2)9/h4-5,7H,3,6,9H2,1-2H3/t7-/m1/s1.
What are the key properties of (2R)-1-(1-ethylimidazol-2-yl)propan-2-amine?
(2R)-1-(1-ethylimidazol-2-yl)propan-2-amine has a molecular weight of 153.23 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(1-ethylimidazol-2-yl)propan-2-amine is sourced from PubChem (CID 92763393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).