Acoltremon

C18H27NO2 — CID 11266244

💊View drug profile → acoltremon
IUPAC(1R,2S,5R)-N-(4-methoxyphenyl)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
SMILESCOc1ccc(NC(=O)[C@@H]2C[C@H](C)CC[C@H]2C(C)C)cc1
InChIInChI=1S/C18H27NO2/c1-12(2)16-10-5-13(3)11-17(16)18(20)19-14-6-8-15(21-4)9-7-14/h6-9,12-13,16-17H,5,10-11H2,1-4H3,(H,19,20)/t13-,16+,17-/m1/s1
InChIKeyHNSGVPAAXJJOPQ-XOKHGSTOSA-N
MW289.42 g/mol
LogP4.34
Rot. Bonds4

About Acoltremon

Acoltremon (PubChem CID 11266244) has the molecular formula C18H27NO2 and a molecular weight of 289.42 g/mol. Its IUPAC name is (1R,2S,5R)-N-(4-methoxyphenyl)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameAcoltremon
PubChem CID11266244
Molecular FormulaC18H27NO2
Molecular Weight289.42 g/mol
Exact Mass289.20
IUPAC Name(1R,2S,5R)-N-(4-methoxyphenyl)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide
SMILESCOc1ccc(NC(=O)[C@@H]2C[C@H](C)CC[C@H]2C(C)C)cc1
InChIInChI=1S/C18H27NO2/c1-12(2)16-10-5-13(3)11-17(16)18(20)19-14-6-8-15(21-4)9-7-14/h6-9,12-13,16-17H,5,10-11H2,1-4H3,(H,19,20)/t13-,16+,17-/m1/s1
InChIKeyHNSGVPAAXJJOPQ-XOKHGSTOSA-N
XLogP4.34
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze Acoltremon with MolForge

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

Launch Full Analysis

Related Compounds

N-(4-methoxyphenyl)-4-methylbenzamide
CID 531829
N-(4-methoxyphenyl)-2-(1-naphthyl)acetamide
CID 835395
2-cyclohexyl-N-(4-methoxyphenyl)acetamide
CID 880925
N-(2-methoxy-5-methylphenyl)-2-phenylcyclopropane-1-carboxamide
CID 2862625
2-Fluoro-N-(4-methoxyphenyl)benzamide
CID 579408
N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-1-phenylcyclopentane-1-carboxamide
CID 4880035
2-(1-adamantyl)-N-[4-(2-amino-2-oxoethoxy)phenyl]acetamide
CID 4921011

Frequently Asked Questions

What is the IUPAC name of Acoltremon?
The IUPAC name of Acoltremon (CID 11266244) is (1R,2S,5R)-N-(4-methoxyphenyl)-5-methyl-2-propan-2-ylcyclohexane-1-carboxamide.
What is the SMILES notation for Acoltremon?
The canonical SMILES for Acoltremon is COc1ccc(NC(=O)[C@@H]2C[C@H](C)CC[C@H]2C(C)C)cc1.
What is the InChIKey of Acoltremon?
The InChIKey is HNSGVPAAXJJOPQ-XOKHGSTOSA-N. The full InChI is InChI=1S/C18H27NO2/c1-12(2)16-10-5-13(3)11-17(16)18(20)19-14-6-8-15(21-4)9-7-14/h6-9,12-13,16-17H,5,10-11H2,1-4H3,(H,19,20)/t13-,16+,17-/m1/s1.
What are the key properties of Acoltremon?
Acoltremon has a molecular weight of 289.42 g/mol, XLogP of 4.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Acoltremon is sourced from PubChem (CID 11266244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).