1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine

C17H30N2S — CID 64753485

IUPAC1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
SMILESCCCNC1(c2nc(CC)c(C)s2)CC(C)CC(C)C1
InChIInChI=1S/C17H30N2S/c1-6-8-18-17(10-12(3)9-13(4)11-17)16-19-15(7-2)14(5)20-16/h12-13,18H,6-11H2,1-5H3
InChIKeyYYJPUGGCHPRHAQ-UHFFFAOYSA-N
MW294.51 g/mol
LogP4.66
Rot. Bonds5

About 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine

1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine (PubChem CID 64753485) has the molecular formula C17H30N2S and a molecular weight of 294.51 g/mol. Its IUPAC name is 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
PubChem CID64753485
Molecular FormulaC17H30N2S
Molecular Weight294.51 g/mol
Exact Mass294.21
IUPAC Name1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
SMILESCCCNC1(c2nc(CC)c(C)s2)CC(C)CC(C)C1
InChIInChI=1S/C17H30N2S/c1-6-8-18-17(10-12(3)9-13(4)11-17)16-19-15(7-2)14(5)20-16/h12-13,18H,6-11H2,1-5H3
InChIKeyYYJPUGGCHPRHAQ-UHFFFAOYSA-N
XLogP4.66
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.51
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2,4-dimethyl-N-propylcyclohexan-1-amine
CID 64755391
4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-1-methyl-N-propylpiperidin-4-amine
CID 61336145
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-methyl-N-propylcyclopentan-1-amine
CID 65045363
1-(4-tert-butyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine
CID 64751126
3-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-N-(2-methoxyethyl)-5-methylthiolan-3-amine
CID 79950737
N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,4-dimethylcyclohexan-1-amine
CID 64746458
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-4-methyl-N-propan-2-ylcyclohexan-1-amine
CID 61333258
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79862410
N-cyclopropyl-1-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethylcyclohexan-1-amine
CID 64751318
N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)cyclooctan-1-amine
CID 61332758
N-ethyl-4-(4-ethyl-5-methyl-1,3-thiazol-2-yl)thian-4-amine
CID 61330052
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclobutan-1-amine
CID 61334037

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine?
The IUPAC name of 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine (CID 64753485) is 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine.
What is the SMILES notation for 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine?
The canonical SMILES for 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine is CCCNC1(c2nc(CC)c(C)s2)CC(C)CC(C)C1.
What is the InChIKey of 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine?
The InChIKey is YYJPUGGCHPRHAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2S/c1-6-8-18-17(10-12(3)9-13(4)11-17)16-19-15(7-2)14(5)20-16/h12-13,18H,6-11H2,1-5H3.
What are the key properties of 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine?
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine has a molecular weight of 294.51 g/mol, XLogP of 4.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-N-propylcyclohexan-1-amine is sourced from PubChem (CID 64753485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).