2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine

C11H19N3 — CID 82401692

IUPAC2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine
SMILESCc1cnc(C(N)CC2CCCC2)[nH]1
InChIInChI=1S/C11H19N3/c1-8-7-13-11(14-8)10(12)6-9-4-2-3-5-9/h7,9-10H,2-6,12H2,1H3,(H,13,14)
InChIKeyBNQJXYYWLKUDQR-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.30
Rot. Bonds3

About 2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine

2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine (PubChem CID 82401692) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine
PubChem CID82401692
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine
SMILESCc1cnc(C(N)CC2CCCC2)[nH]1
InChIInChI=1S/C11H19N3/c1-8-7-13-11(14-8)10(12)6-9-4-2-3-5-9/h7,9-10H,2-6,12H2,1H3,(H,13,14)
InChIKeyBNQJXYYWLKUDQR-UHFFFAOYSA-N
XLogP2.30
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine?
The IUPAC name of 2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine (CID 82401692) is 2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine.
What is the SMILES notation for 2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine?
The canonical SMILES for 2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine is Cc1cnc(C(N)CC2CCCC2)[nH]1.
What is the InChIKey of 2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine?
The InChIKey is BNQJXYYWLKUDQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-8-7-13-11(14-8)10(12)6-9-4-2-3-5-9/h7,9-10H,2-6,12H2,1H3,(H,13,14).
What are the key properties of 2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine?
2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine has a molecular weight of 193.29 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(5-methyl-1H-imidazol-2-yl)ethanamine is sourced from PubChem (CID 82401692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).