[2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine

C14H24N2S — CID 114361233

IUPAC[2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine
SMILESCCCc1nc(C2CCC(C)CC2)sc1CN
InChIInChI=1S/C14H24N2S/c1-3-4-12-13(9-15)17-14(16-12)11-7-5-10(2)6-8-11/h10-11H,3-9,15H2,1-2H3
InChIKeyPENARBTVNAARIT-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.85
Rot. Bonds4

About [2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine

[2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine (PubChem CID 114361233) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is [2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine.

Molecular Properties

Compound Name[2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine
PubChem CID114361233
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name[2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine
SMILESCCCc1nc(C2CCC(C)CC2)sc1CN
InChIInChI=1S/C14H24N2S/c1-3-4-12-13(9-15)17-14(16-12)11-7-5-10(2)6-8-11/h10-11H,3-9,15H2,1-2H3
InChIKeyPENARBTVNAARIT-UHFFFAOYSA-N
XLogP3.85
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-propyl-2-(thiolan-2-yl)-1,3-thiazol-5-yl]methanamine
CID 114361282
(2-cyclobutyl-4-ethyl-1,3-thiazol-5-yl)methanamine
CID 104840931
[2-(oxan-3-yl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 114361278
[2-(3,3-difluorocyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine
CID 114216484
1-[4-ethyl-2-(4-methylcyclohexyl)-1,3-thiazol-5-yl]-N-methylmethanamine
CID 104841127
N-[(2-cyclopropyl-4-propyl-1,3-thiazol-5-yl)methyl]-2-methylpropan-1-amine
CID 82432254
N-[(2-cyclopropyl-4-propyl-1,3-thiazol-5-yl)methyl]butan-2-amine
CID 82432255
1-[2-(4-tert-butylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]-N-methylmethanamine
CID 114363593
N-methyl-1-[4-propyl-2-(4-propylcyclohexyl)-1,3-thiazol-5-yl]methanamine
CID 114363337
N-[(2-cyclohexyl-4-propyl-1,3-thiazol-5-yl)methyl]ethanamine
CID 82432400
N-[(2-cyclopropyl-4-propyl-1,3-thiazol-5-yl)methyl]-2-methoxyethanamine
CID 82432257
[4-ethyl-2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1,3-thiazol-5-yl]methanamine
CID 113459578

Frequently Asked Questions

What is the IUPAC name of [2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine?
The IUPAC name of [2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine (CID 114361233) is [2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine.
What is the SMILES notation for [2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine?
The canonical SMILES for [2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine is CCCc1nc(C2CCC(C)CC2)sc1CN.
What is the InChIKey of [2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine?
The InChIKey is PENARBTVNAARIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-3-4-12-13(9-15)17-14(16-12)11-7-5-10(2)6-8-11/h10-11H,3-9,15H2,1-2H3.
What are the key properties of [2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine?
[2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine has a molecular weight of 252.43 g/mol, XLogP of 3.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methylcyclohexyl)-4-propyl-1,3-thiazol-5-yl]methanamine is sourced from PubChem (CID 114361233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).