N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide

C15H23N3OS — CID 155186238

IUPACN-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide
SMILESCNC1CC(C(=O)Nc2ncc(C3CCCCC3)s2)C1
InChIInChI=1S/C15H23N3OS/c1-16-12-7-11(8-12)14(19)18-15-17-9-13(20-15)10-5-3-2-4-6-10/h9-12,16H,2-8H2,1H3,(H,17,18,19)
InChIKeyCXJXEYXUWLRMOQ-UHFFFAOYSA-N
MW293.44 g/mol
LogP3.13
Rot. Bonds4

About N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide

N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide (PubChem CID 155186238) has the molecular formula C15H23N3OS and a molecular weight of 293.44 g/mol. Its IUPAC name is N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide
PubChem CID155186238
Molecular FormulaC15H23N3OS
Molecular Weight293.44 g/mol
Exact Mass293.16
IUPAC NameN-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide
SMILESCNC1CC(C(=O)Nc2ncc(C3CCCCC3)s2)C1
InChIInChI=1S/C15H23N3OS/c1-16-12-7-11(8-12)14(19)18-15-17-9-13(20-15)10-5-3-2-4-6-10/h9-12,16H,2-8H2,1H3,(H,17,18,19)
InChIKeyCXJXEYXUWLRMOQ-UHFFFAOYSA-N
XLogP3.13
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide?
The IUPAC name of N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide (CID 155186238) is N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide.
What is the SMILES notation for N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide?
The canonical SMILES for N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide is CNC1CC(C(=O)Nc2ncc(C3CCCCC3)s2)C1.
What is the InChIKey of N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide?
The InChIKey is CXJXEYXUWLRMOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3OS/c1-16-12-7-11(8-12)14(19)18-15-17-9-13(20-15)10-5-3-2-4-6-10/h9-12,16H,2-8H2,1H3,(H,17,18,19).
What are the key properties of N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide?
N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide has a molecular weight of 293.44 g/mol, XLogP of 3.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclohexyl-1,3-thiazol-2-yl)-3-(methylamino)cyclobutane-1-carboxamide is sourced from PubChem (CID 155186238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).