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

C11H18N2S — CID 83262106

IUPAC4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine
SMILESCc1nc(CC2CCC(N)CC2)cs1
InChIInChI=1S/C11H18N2S/c1-8-13-11(7-14-8)6-9-2-4-10(12)5-3-9/h7,9-10H,2-6,12H2,1H3
InChIKeyNFFMCDBNVMEYLU-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.51
Rot. Bonds2

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

4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine (PubChem CID 83262106) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine
PubChem CID83262106
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine
SMILESCc1nc(CC2CCC(N)CC2)cs1
InChIInChI=1S/C11H18N2S/c1-8-13-11(7-14-8)6-9-2-4-10(12)5-3-9/h7,9-10H,2-6,12H2,1H3
InChIKeyNFFMCDBNVMEYLU-UHFFFAOYSA-N
XLogP2.51
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cyclohexylmethyl)-2-methyl-1,3-thiazole
CID 174858890
4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexane-1-carboxylic acid
CID 172582162
3-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]cyclopentane-1,3-diamine
CID 106039550
8-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 106039600
[4-cyclopropyl-1-(2-methyl-1,3-thiazol-4-yl)butan-2-yl]hydrazine
CID 105214723
4-ethyl-2-methyl-1,3-thiazole;hydrochloride
CID 141419064
2-(aminomethyl)-2-(cyclopropylmethyl)-3-(2-methyl-1,3-thiazol-4-yl)propan-1-ol
CID 106506878
3-[[(2-methyl-1,3-thiazol-4-yl)methylamino]methyl]cyclohexan-1-amine
CID 63046471
1-(2-methyl-1,3-thiazol-4-yl)piperidin-4-amine
CID 130831630
5-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-amine
CID 79986577
2-cyclopropyl-2-fluoro-3-(2-methyl-1,3-thiazol-4-yl)propan-1-amine
CID 112567195
2-(aminomethyl)-2-(cyclopropylmethyl)-3-(2-methyl-1,3-thiazol-4-yl)propanoic acid
CID 106490163

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine (CID 83262106) is 4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine is Cc1nc(CC2CCC(N)CC2)cs1.
What is the InChIKey of 4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine?
The InChIKey is NFFMCDBNVMEYLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-8-13-11(7-14-8)6-9-2-4-10(12)5-3-9/h7,9-10H,2-6,12H2,1H3.
What are the key properties of 4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine?
4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine has a molecular weight of 210.35 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 83262106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).