3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide

C12H18N2OS — CID 711478

IUPAC3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide
SMILESO=C(CCC1CCCCC1)Nc1nccs1
InChIInChI=1S/C12H18N2OS/c15-11(14-12-13-8-9-16-12)7-6-10-4-2-1-3-5-10/h8-10H,1-7H2,(H,13,14,15)
InChIKeyZYFZMZOKRIQYMJ-UHFFFAOYSA-N
MW238.36 g/mol
LogP3.44
Rot. Bonds4

About 3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide

3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 711478) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is 3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide
PubChem CID711478
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC Name3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide
SMILESO=C(CCC1CCCCC1)Nc1nccs1
InChIInChI=1S/C12H18N2OS/c15-11(14-12-13-8-9-16-12)7-6-10-4-2-1-3-5-10/h8-10H,1-7H2,(H,13,14,15)
InChIKeyZYFZMZOKRIQYMJ-UHFFFAOYSA-N
XLogP3.44
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Propanamide, 3-(4-methyl-1-piperidyl)-N-(2-thiazolyl)-
CID 574554
2-cyclopentyl-N-(1,3-thiazol-2-yl)acetamide
CID 2666601
2-(1-methyl-2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)-N-(1,3-thiazol-2-yl)acetamide
CID 8141687
N-(1,3-thiazol-2-yl)bicyclo[2.2.1]heptane-2-carboxamide
CID 3121269
N-1,3-thiazol-2-ylbicyclo[6.1.0]non-2-ene-9-carboxamide
CID 5741681
4-tert-butyl-N-(1,3-thiazol-2-yl)cyclohexane-1-carboxamide
CID 1246597
N-(1,3-thiazol-2-yl)cyclohex-3-ene-1-carboxamide
CID 16311738
2-[(2-Thiazolylamino)carbonyl]cyclohexanecarboxylic acid
CID 260992
2-methyl-N-(1,3-thiazol-2-yl)butanamide
CID 3140495
N-(1,3-thiazol-2-yl)piperidine-3-carboxamide
CID 18072276
3-acetamido-N-(1,3-thiazol-2-yl)adamantane-1-carboxamide
CID 2999599
2-[2-(Thiazol-2-ylcarbamoyl)-ethyl]-hexanoic acid
CID 3142080

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide (CID 711478) is 3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide is O=C(CCC1CCCCC1)Nc1nccs1.
What is the InChIKey of 3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is ZYFZMZOKRIQYMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c15-11(14-12-13-8-9-16-12)7-6-10-4-2-1-3-5-10/h8-10H,1-7H2,(H,13,14,15).
What are the key properties of 3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide?
3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 238.36 g/mol, XLogP of 3.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 711478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).