2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine

C12H20N2S — CID 112642174

IUPAC2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine
SMILESCCC1CCCCC1(N)Cc1cncs1
InChIInChI=1S/C12H20N2S/c1-2-10-5-3-4-6-12(10,13)7-11-8-14-9-15-11/h8-10H,2-7,13H2,1H3
InChIKeyBLQHHIMHBWZJOQ-UHFFFAOYSA-N
MW224.37 g/mol
LogP2.98
Rot. Bonds3

About 2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine

2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine (PubChem CID 112642174) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is 2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine
PubChem CID112642174
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine
SMILESCCC1CCCCC1(N)Cc1cncs1
InChIInChI=1S/C12H20N2S/c1-2-10-5-3-4-6-12(10,13)7-11-8-14-9-15-11/h8-10H,2-7,13H2,1H3
InChIKeyBLQHHIMHBWZJOQ-UHFFFAOYSA-N
XLogP2.98
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-1-(1,3-thiazol-5-ylmethyl)cycloheptan-1-amine
CID 112642190
1-(1,3-thiazol-5-ylmethyl)cycloheptan-1-amine
CID 112642126
3-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine
CID 112642173
2-ethyl-1-[(1-methyltriazol-4-yl)methyl]cyclohexan-1-amine
CID 107046702
1-(1,3-benzothiazol-2-ylmethyl)-2-ethylcyclohexan-1-amine
CID 79819494
2-ethyl-1-[(1-ethylimidazol-2-yl)methyl]cyclohexan-1-amine
CID 79744542
[3-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclopentyl]methanamine
CID 112645149
2-methoxy-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-ol
CID 106873763
1-(1-ethoxycyclopentyl)-2-(1,3-thiazol-5-yl)ethanamine
CID 116761823
2-ethyl-1-(2-ethylbutyl)cyclohexan-1-amine
CID 82920876
[4-propan-2-yl-1-(1,3-thiazol-5-ylmethyl)cyclohexyl]methanamine
CID 112645146
4-ethyl-3-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine
CID 165498055

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine (CID 112642174) is 2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine is CCC1CCCCC1(N)Cc1cncs1.
What is the InChIKey of 2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine?
The InChIKey is BLQHHIMHBWZJOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-2-10-5-3-4-6-12(10,13)7-11-8-14-9-15-11/h8-10H,2-7,13H2,1H3.
What are the key properties of 2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine?
2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine has a molecular weight of 224.37 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(1,3-thiazol-5-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 112642174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).