2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine

C14H23N3O — CID 62385208

IUPAC2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine
SMILESCn1c(C2CCCC2)nc(C2CCOCC2)c1N
InChIInChI=1S/C14H23N3O/c1-17-13(15)12(10-6-8-18-9-7-10)16-14(17)11-4-2-3-5-11/h10-11H,2-9,15H2,1H3
InChIKeyUDSLGXYHYSPAAU-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.55
Rot. Bonds2

About 2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine

2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine (PubChem CID 62385208) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine.

Molecular Properties

Compound Name2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine
PubChem CID62385208
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine
SMILESCn1c(C2CCCC2)nc(C2CCOCC2)c1N
InChIInChI=1S/C14H23N3O/c1-17-13(15)12(10-6-8-18-9-7-10)16-14(17)11-4-2-3-5-11/h10-11H,2-9,15H2,1H3
InChIKeyUDSLGXYHYSPAAU-UHFFFAOYSA-N
XLogP2.55
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine?
The IUPAC name of 2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine (CID 62385208) is 2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine.
What is the SMILES notation for 2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine?
The canonical SMILES for 2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine is Cn1c(C2CCCC2)nc(C2CCOCC2)c1N.
What is the InChIKey of 2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine?
The InChIKey is UDSLGXYHYSPAAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-17-13(15)12(10-6-8-18-9-7-10)16-14(17)11-4-2-3-5-11/h10-11H,2-9,15H2,1H3.
What are the key properties of 2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine?
2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine has a molecular weight of 249.36 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-methyl-5-(oxan-4-yl)imidazol-4-amine is sourced from PubChem (CID 62385208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).