1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine

C15H22N4S — CID 106566619

IUPAC1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine
SMILESCc1nc(C)c(C(C)Nc2nccn2C2CCCC2)s1
InChIInChI=1S/C15H22N4S/c1-10-14(20-12(3)17-10)11(2)18-15-16-8-9-19(15)13-6-4-5-7-13/h8-9,11,13H,4-7H2,1-3H3,(H,16,18)
InChIKeyAXXBCKHENKXALW-UHFFFAOYSA-N
MW290.44 g/mol
LogP4.24
Rot. Bonds4

About 1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine

1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine (PubChem CID 106566619) has the molecular formula C15H22N4S and a molecular weight of 290.44 g/mol. Its IUPAC name is 1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine
PubChem CID106566619
Molecular FormulaC15H22N4S
Molecular Weight290.44 g/mol
Exact Mass290.16
IUPAC Name1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine
SMILESCc1nc(C)c(C(C)Nc2nccn2C2CCCC2)s1
InChIInChI=1S/C15H22N4S/c1-10-14(20-12(3)17-10)11(2)18-15-16-8-9-19(15)13-6-4-5-7-13/h8-9,11,13H,4-7H2,1-3H3,(H,16,18)
InChIKeyAXXBCKHENKXALW-UHFFFAOYSA-N
XLogP4.24
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.44
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine?
The IUPAC name of 1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine (CID 106566619) is 1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine.
What is the SMILES notation for 1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine?
The canonical SMILES for 1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine is Cc1nc(C)c(C(C)Nc2nccn2C2CCCC2)s1.
What is the InChIKey of 1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine?
The InChIKey is AXXBCKHENKXALW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4S/c1-10-14(20-12(3)17-10)11(2)18-15-16-8-9-19(15)13-6-4-5-7-13/h8-9,11,13H,4-7H2,1-3H3,(H,16,18).
What are the key properties of 1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine?
1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine has a molecular weight of 290.44 g/mol, XLogP of 4.24, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106566619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).