2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine

C11H21N3 — CID 82237987

IUPAC2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine
SMILESCCCC(C)(N)c1ncc(C(C)C)[nH]1
InChIInChI=1S/C11H21N3/c1-5-6-11(4,12)10-13-7-9(14-10)8(2)3/h7-8H,5-6,12H2,1-4H3,(H,13,14)
InChIKeyGYBJOUNUFYJYQM-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.51
Rot. Bonds4

About 2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine

2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine (PubChem CID 82237987) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine.

Molecular Properties

Compound Name2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine
PubChem CID82237987
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine
SMILESCCCC(C)(N)c1ncc(C(C)C)[nH]1
InChIInChI=1S/C11H21N3/c1-5-6-11(4,12)10-13-7-9(14-10)8(2)3/h7-8H,5-6,12H2,1-4H3,(H,13,14)
InChIKeyGYBJOUNUFYJYQM-UHFFFAOYSA-N
XLogP2.51
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine?
The IUPAC name of 2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine (CID 82237987) is 2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine.
What is the SMILES notation for 2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine?
The canonical SMILES for 2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine is CCCC(C)(N)c1ncc(C(C)C)[nH]1.
What is the InChIKey of 2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine?
The InChIKey is GYBJOUNUFYJYQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-5-6-11(4,12)10-13-7-9(14-10)8(2)3/h7-8H,5-6,12H2,1-4H3,(H,13,14).
What are the key properties of 2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine?
2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine has a molecular weight of 195.31 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-propan-2-yl-1H-imidazol-2-yl)pentan-2-amine is sourced from PubChem (CID 82237987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).