(4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine

C11H18N2S — CID 105464505

IUPAC(4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine
SMILESCc1sc(CN)nc1C1CCCCC1
InChIInChI=1S/C11H18N2S/c1-8-11(13-10(7-12)14-8)9-5-3-2-4-6-9/h9H,2-7,12H2,1H3
InChIKeyQONBJEXDJYMPKZ-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.96
Rot. Bonds2

About (4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine

(4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine (PubChem CID 105464505) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is (4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine.

Molecular Properties

Compound Name(4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine
PubChem CID105464505
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name(4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine
SMILESCc1sc(CN)nc1C1CCCCC1
InChIInChI=1S/C11H18N2S/c1-8-11(13-10(7-12)14-8)9-5-3-2-4-6-9/h9H,2-7,12H2,1H3
InChIKeyQONBJEXDJYMPKZ-UHFFFAOYSA-N
XLogP2.96
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 ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-cyclohexyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 116829047
2-amino-3-(4-cyclobutyl-5-methyl-1,3-thiazol-2-yl)propanoic acid
CID 116868149
4-cyclobutyl-5-methyl-2-(pyrrolidin-3-ylmethyl)-1,3-thiazole
CID 116829036
2-[5-methyl-4-(thiolan-3-yl)-1,3-thiazol-2-yl]ethanamine
CID 115036882
(2-cycloheptyl-4-methyl-1,3-thiazol-5-yl)methanamine
CID 65400000
2-(4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)-2-methylpropanoic acid
CID 116865686
(4-cyclopropyl-2-ethyl-1,3-thiazol-5-yl)methanamine
CID 82435899
(4-cyclopentyl-2-methyl-1H-imidazol-5-yl)methanamine
CID 82373877
1-(4-cyclopentyl-5-methyl-1,3-thiazol-2-yl)cyclobutane-1-carbonitrile
CID 116865599
2-ethyl-5-methyl-4-piperidin-2-yl-1,3-thiazole
CID 115027143
[5-methyl-4-(oxolan-3-yl)-1,3-thiazol-2-yl]methanol
CID 115021751
[4-(1,1-dioxothiolan-3-yl)-5-methyl-1,3-thiazol-2-yl]methanol
CID 115046099

Frequently Asked Questions

What is the IUPAC name of (4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine?
The IUPAC name of (4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine (CID 105464505) is (4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine.
What is the SMILES notation for (4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine?
The canonical SMILES for (4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine is Cc1sc(CN)nc1C1CCCCC1.
What is the InChIKey of (4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine?
The InChIKey is QONBJEXDJYMPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-8-11(13-10(7-12)14-8)9-5-3-2-4-6-9/h9H,2-7,12H2,1H3.
What are the key properties of (4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine?
(4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine has a molecular weight of 210.35 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclohexyl-5-methyl-1,3-thiazol-2-yl)methanamine is sourced from PubChem (CID 105464505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).