4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine

C13H22N4S — CID 62808150

IUPAC4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine
SMILESNC1CCC(N2CCN(c3nccs3)CC2)CC1
InChIInChI=1S/C13H22N4S/c14-11-1-3-12(4-2-11)16-6-8-17(9-7-16)13-15-5-10-18-13/h5,10-12H,1-4,6-9,14H2
InChIKeyXGQUOUQPPXKEBU-UHFFFAOYSA-N
MW266.41 g/mol
LogP1.53
Rot. Bonds2

About 4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine

4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine (PubChem CID 62808150) has the molecular formula C13H22N4S and a molecular weight of 266.41 g/mol. Its IUPAC name is 4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine
PubChem CID62808150
Molecular FormulaC13H22N4S
Molecular Weight266.41 g/mol
Exact Mass266.16
IUPAC Name4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine
SMILESNC1CCC(N2CCN(c3nccs3)CC2)CC1
InChIInChI=1S/C13H22N4S/c14-11-1-3-12(4-2-11)16-6-8-17(9-7-16)13-15-5-10-18-13/h5,10-12H,1-4,6-9,14H2
InChIKeyXGQUOUQPPXKEBU-UHFFFAOYSA-N
XLogP1.53
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(oxan-4-yl)piperazin-1-yl]-1,3-thiazole
CID 75496874
2-(4-piperidin-1-ylpiperidin-1-yl)-1,3-thiazole
CID 172900709
3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclopentan-1-one
CID 79643158
2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-ol
CID 60714895
1-(1,3-thiazol-2-yl)azetidin-3-amine;dihydrochloride
CID 91623902
4-(4-pyridin-2-ylpiperazin-1-yl)cyclohexan-1-amine
CID 15045421
2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazol-4-amine
CID 64976803
2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclopentane-1-carbonitrile
CID 43291625
3-(4-methylpiperazin-1-yl)-8-(1,3-thiazol-2-yl)-1-oxa-8-azaspiro[4.5]decane
CID 131641802
cyclopropyl-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
CID 53498835
2-(4-methylsulfonylpiperidin-1-yl)-1,3-thiazole
CID 167862176
ethane;2-pyrrolidin-1-yl-1,3-thiazole
CID 176952882

Frequently Asked Questions

What is the IUPAC name of 4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine?
The IUPAC name of 4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine (CID 62808150) is 4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine.
What is the SMILES notation for 4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine?
The canonical SMILES for 4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine is NC1CCC(N2CCN(c3nccs3)CC2)CC1.
What is the InChIKey of 4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine?
The InChIKey is XGQUOUQPPXKEBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4S/c14-11-1-3-12(4-2-11)16-6-8-17(9-7-16)13-15-5-10-18-13/h5,10-12H,1-4,6-9,14H2.
What are the key properties of 4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine?
4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine has a molecular weight of 266.41 g/mol, XLogP of 1.53, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclohexan-1-amine is sourced from PubChem (CID 62808150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).