4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine

C15H26N2OS — CID 126726066

IUPAC4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine
SMILESCCCN(CCOC)c1nc(C2CCCCC2)cs1
InChIInChI=1S/C15H26N2OS/c1-3-9-17(10-11-18-2)15-16-14(12-19-15)13-7-5-4-6-8-13/h12-13H,3-11H2,1-2H3
InChIKeyKMZCHQUOUHMCAV-UHFFFAOYSA-N
MW282.45 g/mol
LogP4.05
Rot. Bonds7

About 4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine

4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine (PubChem CID 126726066) has the molecular formula C15H26N2OS and a molecular weight of 282.45 g/mol. Its IUPAC name is 4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine
PubChem CID126726066
Molecular FormulaC15H26N2OS
Molecular Weight282.45 g/mol
Exact Mass282.18
IUPAC Name4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine
SMILESCCCN(CCOC)c1nc(C2CCCCC2)cs1
InChIInChI=1S/C15H26N2OS/c1-3-9-17(10-11-18-2)15-16-14(12-19-15)13-7-5-4-6-8-13/h12-13H,3-11H2,1-2H3
InChIKeyKMZCHQUOUHMCAV-UHFFFAOYSA-N
XLogP4.05
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.45
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine?
The IUPAC name of 4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine (CID 126726066) is 4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine is CCCN(CCOC)c1nc(C2CCCCC2)cs1.
What is the InChIKey of 4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine?
The InChIKey is KMZCHQUOUHMCAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2OS/c1-3-9-17(10-11-18-2)15-16-14(12-19-15)13-7-5-4-6-8-13/h12-13H,3-11H2,1-2H3.
What are the key properties of 4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine?
4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine has a molecular weight of 282.45 g/mol, XLogP of 4.05, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-(2-methoxyethyl)-N-propyl-1,3-thiazol-2-amine is sourced from PubChem (CID 126726066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).