4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine

C15H24N2S — CID 116885301

IUPAC4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine
SMILESCc1nc(C2CCCC2)sc1C1CCC(N)CC1
InChIInChI=1S/C15H24N2S/c1-10-14(11-6-8-13(16)9-7-11)18-15(17-10)12-4-2-3-5-12/h11-13H,2-9,16H2,1H3
InChIKeyXNZBBAYVPKUJSW-UHFFFAOYSA-N
MW264.44 g/mol
LogP4.09
Rot. Bonds2

About 4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine

4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine (PubChem CID 116885301) has the molecular formula C15H24N2S and a molecular weight of 264.44 g/mol. Its IUPAC name is 4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine
PubChem CID116885301
Molecular FormulaC15H24N2S
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC Name4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine
SMILESCc1nc(C2CCCC2)sc1C1CCC(N)CC1
InChIInChI=1S/C15H24N2S/c1-10-14(11-6-8-13(16)9-7-11)18-15(17-10)12-4-2-3-5-12/h11-13H,2-9,16H2,1H3
InChIKeyXNZBBAYVPKUJSW-UHFFFAOYSA-N
XLogP4.09
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine?
The IUPAC name of 4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine (CID 116885301) is 4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine.
What is the SMILES notation for 4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine?
The canonical SMILES for 4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine is Cc1nc(C2CCCC2)sc1C1CCC(N)CC1.
What is the InChIKey of 4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine?
The InChIKey is XNZBBAYVPKUJSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2S/c1-10-14(11-6-8-13(16)9-7-11)18-15(17-10)12-4-2-3-5-12/h11-13H,2-9,16H2,1H3.
What are the key properties of 4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine?
4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine has a molecular weight of 264.44 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopentyl-4-methyl-1,3-thiazol-5-yl)cyclohexan-1-amine is sourced from PubChem (CID 116885301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).