2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine

C14H25N3O — CID 106676304

IUPAC2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine
SMILESCOC(C)(C)Cc1nc(C2CCCC2)n(C)c1N
InChIInChI=1S/C14H25N3O/c1-14(2,18-4)9-11-12(15)17(3)13(16-11)10-7-5-6-8-10/h10H,5-9,15H2,1-4H3
InChIKeyWCNPNIBUGWVESD-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.63
Rot. Bonds4

About 2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine

2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine (PubChem CID 106676304) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine.

Molecular Properties

Compound Name2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine
PubChem CID106676304
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine
SMILESCOC(C)(C)Cc1nc(C2CCCC2)n(C)c1N
InChIInChI=1S/C14H25N3O/c1-14(2,18-4)9-11-12(15)17(3)13(16-11)10-7-5-6-8-10/h10H,5-9,15H2,1-4H3
InChIKeyWCNPNIBUGWVESD-UHFFFAOYSA-N
XLogP2.63
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine?
The IUPAC name of 2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine (CID 106676304) is 2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine.
What is the SMILES notation for 2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine?
The canonical SMILES for 2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine is COC(C)(C)Cc1nc(C2CCCC2)n(C)c1N.
What is the InChIKey of 2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine?
The InChIKey is WCNPNIBUGWVESD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-14(2,18-4)9-11-12(15)17(3)13(16-11)10-7-5-6-8-10/h10H,5-9,15H2,1-4H3.
What are the key properties of 2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine?
2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine has a molecular weight of 251.37 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-(2-methoxy-2-methylpropyl)-3-methylimidazol-4-amine is sourced from PubChem (CID 106676304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).