N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide

C14H20N2OS — CID 75389321

IUPACN-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide
SMILESCc1cnc(CCN(C)C(=O)C2C3CCCC32)s1
InChIInChI=1S/C14H20N2OS/c1-9-8-15-12(18-9)6-7-16(2)14(17)13-10-4-3-5-11(10)13/h8,10-11,13H,3-7H2,1-2H3
InChIKeyPISVKBPLLQHHJA-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.50
Rot. Bonds4

About N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide

N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide (PubChem CID 75389321) has the molecular formula C14H20N2OS and a molecular weight of 264.39 g/mol. Its IUPAC name is N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide
PubChem CID75389321
Molecular FormulaC14H20N2OS
Molecular Weight264.39 g/mol
Exact Mass264.13
IUPAC NameN-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide
SMILESCc1cnc(CCN(C)C(=O)C2C3CCCC32)s1
InChIInChI=1S/C14H20N2OS/c1-9-8-15-12(18-9)6-7-16(2)14(17)13-10-4-3-5-11(10)13/h8,10-11,13H,3-7H2,1-2H3
InChIKeyPISVKBPLLQHHJA-UHFFFAOYSA-N
XLogP2.50
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide?
The IUPAC name of N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide (CID 75389321) is N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide.
What is the SMILES notation for N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide?
The canonical SMILES for N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide is Cc1cnc(CCN(C)C(=O)C2C3CCCC32)s1.
What is the InChIKey of N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide?
The InChIKey is PISVKBPLLQHHJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2OS/c1-9-8-15-12(18-9)6-7-16(2)14(17)13-10-4-3-5-11(10)13/h8,10-11,13H,3-7H2,1-2H3.
What are the key properties of N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide?
N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide has a molecular weight of 264.39 g/mol, XLogP of 2.50, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]bicyclo[3.1.0]hexane-6-carboxamide is sourced from PubChem (CID 75389321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).