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

C14H20N2OS — CID 2436055

IUPACN-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide
SMILESO=C(C1CCC1)N(c1nccs1)C1CCCCC1
InChIInChI=1S/C14H20N2OS/c17-13(11-5-4-6-11)16(14-15-9-10-18-14)12-7-2-1-3-8-12/h9-12H,1-8H2
InChIKeyQDFFRAKKTTYGKY-UHFFFAOYSA-N
MW264.39 g/mol
LogP3.61
Rot. Bonds3

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

N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide (PubChem CID 2436055) has the molecular formula C14H20N2OS and a molecular weight of 264.39 g/mol. Its IUPAC name is N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide
PubChem CID2436055
Molecular FormulaC14H20N2OS
Molecular Weight264.39 g/mol
Exact Mass264.13
IUPAC NameN-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide
SMILESO=C(C1CCC1)N(c1nccs1)C1CCCCC1
InChIInChI=1S/C14H20N2OS/c17-13(11-5-4-6-11)16(14-15-9-10-18-14)12-7-2-1-3-8-12/h9-12H,1-8H2
InChIKeyQDFFRAKKTTYGKY-UHFFFAOYSA-N
XLogP3.61
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide?
The IUPAC name of N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide (CID 2436055) is N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide.
What is the SMILES notation for N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide?
The canonical SMILES for N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide is O=C(C1CCC1)N(c1nccs1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide?
The InChIKey is QDFFRAKKTTYGKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2OS/c17-13(11-5-4-6-11)16(14-15-9-10-18-14)12-7-2-1-3-8-12/h9-12H,1-8H2.
What are the key properties of N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide?
N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide has a molecular weight of 264.39 g/mol, XLogP of 3.61, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-(1,3-thiazol-2-yl)cyclobutanecarboxamide is sourced from PubChem (CID 2436055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).