N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide

C12H18N2OS — CID 110717473

IUPACN-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide
SMILESO=C(NCCc1cncs1)C1CCCCC1
InChIInChI=1S/C12H18N2OS/c15-12(10-4-2-1-3-5-10)14-7-6-11-8-13-9-16-11/h8-10H,1-7H2,(H,14,15)
InChIKeyMJTUOLAYCHKJNQ-UHFFFAOYSA-N
MW238.36 g/mol
LogP2.38
Rot. Bonds4

About N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide

N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide (PubChem CID 110717473) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide
PubChem CID110717473
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC NameN-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide
SMILESO=C(NCCc1cncs1)C1CCCCC1
InChIInChI=1S/C12H18N2OS/c15-12(10-4-2-1-3-5-10)14-7-6-11-8-13-9-16-11/h8-10H,1-7H2,(H,14,15)
InChIKeyMJTUOLAYCHKJNQ-UHFFFAOYSA-N
XLogP2.38
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 ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cis-(1R,3S)-3-[2-(1,3-thiazol-5-yl)ethylcarbamoyl]cyclopentane-1-carboxylic acid
CID 166254916
1-cyclohexyl-3-(1,3-thiazol-5-ylmethyl)urea
CID 104588445
5-[2-(cyclohexanecarbonylamino)ethyl]thiophene-2-sulfonyl chloride
CID 43098333
N-[2-(4-hydroxyphenyl)ethyl]cyclooctanecarboxamide
CID 65023099
1-(cyclohexanecarbonyl)-N-[2-(1,3-thiazol-4-yl)ethyl]piperidine-4-carboxamide
CID 46390073
2-(2-chlorophenyl)-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide
CID 110717557
N-[2-(1-benzothiophen-3-yl)ethyl]cyclohexanecarboxamide
CID 87005605
N-[2-(5-acetylthiophen-2-yl)ethyl]cyclobutanecarboxamide
CID 91817317
N-[2-(4-aminophenyl)ethyl]cyclohexanecarboxamide;hydrochloride
CID 119260663
N-[2-(furan-2-yl)ethyl]cyclopentanecarboxamide
CID 110733508
2-phenoxy-N-[2-(1,3-thiazol-5-yl)ethyl]acetamide
CID 110717509
1-cyclohexyl-1-hydroxy-3-(1,3-thiazol-5-yl)propan-2-one
CID 103457418

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide (CID 110717473) is N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide is O=C(NCCc1cncs1)C1CCCCC1.
What is the InChIKey of N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide?
The InChIKey is MJTUOLAYCHKJNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c15-12(10-4-2-1-3-5-10)14-7-6-11-8-13-9-16-11/h8-10H,1-7H2,(H,14,15).
What are the key properties of N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide?
N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide has a molecular weight of 238.36 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,3-thiazol-5-yl)ethyl]cyclohexanecarboxamide is sourced from PubChem (CID 110717473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).