2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine

C8H15N3 — CID 10034813

IUPAC2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine
SMILESCC(C)c1ncc(CCN)[nH]1
InChIInChI=1S/C8H15N3/c1-6(2)8-10-5-7(11-8)3-4-9/h5-6H,3-4,9H2,1-2H3,(H,10,11)
InChIKeyVVACTURLJWWFGU-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.03
Rot. Bonds3

About 2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine

2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine (PubChem CID 10034813) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine
PubChem CID10034813
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine
SMILESCC(C)c1ncc(CCN)[nH]1
InChIInChI=1S/C8H15N3/c1-6(2)8-10-5-7(11-8)3-4-9/h5-6H,3-4,9H2,1-2H3,(H,10,11)
InChIKeyVVACTURLJWWFGU-UHFFFAOYSA-N
XLogP1.03
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine?
The IUPAC name of 2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine (CID 10034813) is 2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine.
What is the SMILES notation for 2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine?
The canonical SMILES for 2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine is CC(C)c1ncc(CCN)[nH]1.
What is the InChIKey of 2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine?
The InChIKey is VVACTURLJWWFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-6(2)8-10-5-7(11-8)3-4-9/h5-6H,3-4,9H2,1-2H3,(H,10,11).
What are the key properties of 2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine?
2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine has a molecular weight of 153.23 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-yl-1H-imidazol-5-yl)ethanamine is sourced from PubChem (CID 10034813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).