2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine

C14H25N3S — CID 62219183

IUPAC2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine
SMILESCSCCc1nc(C2CCCC2)n(C(C)C)c1N
InChIInChI=1S/C14H25N3S/c1-10(2)17-13(15)12(8-9-18-3)16-14(17)11-6-4-5-7-11/h10-11H,4-9,15H2,1-3H3
InChIKeyDTAMXESKRXGXTA-UHFFFAOYSA-N
MW267.44 g/mol
LogP3.61
Rot. Bonds5

About 2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine

2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine (PubChem CID 62219183) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine.

Molecular Properties

Compound Name2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine
PubChem CID62219183
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine
SMILESCSCCc1nc(C2CCCC2)n(C(C)C)c1N
InChIInChI=1S/C14H25N3S/c1-10(2)17-13(15)12(8-9-18-3)16-14(17)11-6-4-5-7-11/h10-11H,4-9,15H2,1-3H3
InChIKeyDTAMXESKRXGXTA-UHFFFAOYSA-N
XLogP3.61
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopentyl-5-ethyl-3-propan-2-ylimidazol-4-amine
CID 62219181
2-cyclopentyl-5-hexyl-3-propan-2-ylimidazol-4-amine
CID 62219186
2-cyclohexyl-5-(2,2-dimethylpropyl)-3-propan-2-ylimidazol-4-amine
CID 62966191
2-cyclopentyl-3-methyl-5-(3-methylsulfanylpropyl)imidazol-4-amine
CID 103090267
2-ethyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine
CID 62224906
2-cyclopentyl-5-(2-ethylsulfanylethyl)-3-(2-methylpropyl)imidazol-4-amine
CID 116504964
2-cyclopentyl-5-phenyl-3-propan-2-ylimidazol-4-amine
CID 62221346
2-cyclopentyl-5-ethyl-3-methylimidazol-4-amine
CID 62219518
2-cyclohexyl-4-pentylimidazole-1,5-diamine
CID 62507105
2-cyclohexyl-4-heptylimidazole-1,5-diamine
CID 63468221
5-(2-chlorophenyl)-2-cyclopentyl-3-propan-2-ylimidazol-4-amine
CID 62221527
2-cyclopentyl-3-propan-2-yl-5-pyridin-3-ylimidazol-4-amine
CID 62221526

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine?
The IUPAC name of 2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine (CID 62219183) is 2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine.
What is the SMILES notation for 2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine?
The canonical SMILES for 2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine is CSCCc1nc(C2CCCC2)n(C(C)C)c1N.
What is the InChIKey of 2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine?
The InChIKey is DTAMXESKRXGXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-10(2)17-13(15)12(8-9-18-3)16-14(17)11-6-4-5-7-11/h10-11H,4-9,15H2,1-3H3.
What are the key properties of 2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine?
2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine has a molecular weight of 267.44 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine is sourced from PubChem (CID 62219183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).