cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol

C19H35NO2 — CID 145338686

IUPACcyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol
SMILESC1CCCC1.CC.CO.Cc1ccc(C)c(CN(C)C=O)c1
InChIInChI=1S/C11H15NO.C5H10.C2H6.CH4O/c1-9-4-5-10(2)11(6-9)7-12(3)8-13;1-2-4-5-3-1;2*1-2/h4-6,8H,7H2,1-3H3;1-5H2;1-2H3;2H,1H3
InChIKeySAZCODRLYJCJDB-UHFFFAOYSA-N
MW309.49 g/mol
LogP4.48
Rot. Bonds3

About cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol

cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol (PubChem CID 145338686) has the molecular formula C19H35NO2 and a molecular weight of 309.49 g/mol. Its IUPAC name is cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol.

Molecular Properties

Compound Namecyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol
PubChem CID145338686
Molecular FormulaC19H35NO2
Molecular Weight309.49 g/mol
Exact Mass309.27
IUPAC Namecyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol
SMILESC1CCCC1.CC.CO.Cc1ccc(C)c(CN(C)C=O)c1
InChIInChI=1S/C11H15NO.C5H10.C2H6.CH4O/c1-9-4-5-10(2)11(6-9)7-12(3)8-13;1-2-4-5-3-1;2*1-2/h4-6,8H,7H2,1-3H3;1-5H2;1-2H3;2H,1H3
InChIKeySAZCODRLYJCJDB-UHFFFAOYSA-N
XLogP4.48
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.49
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol 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-[(2,5-dimethylphenyl)methyl]-N-(2,2,2-trifluoroethyl)formamide;ethane
CID 145338860
[(2,5-dimethylphenyl)methyl-methylamino]methanol
CID 115229092
1-cyclohexyl-2-(2,5-dimethylphenyl)ethanone
CID 61482005
1-(1-aminocyclobutyl)-2-(2,5-dimethylphenyl)ethanone
CID 116598569
N-methyl-N-[(2-methyl-5-thiophen-2-ylphenyl)methyl]formamide
CID 138566649
N-[(2,5-dimethylphenyl)methyl]-N-(oxan-4-yl)formamide
CID 145338580
3-[(2,5-dimethylphenyl)methyl-ethylamino]propanoic acid
CID 61481727
2-[(2,5-dimethylphenyl)methyl-prop-2-enylamino]acetic acid
CID 79277476
N-[(2,5-dimethylphenyl)methyl]-N-methylpropan-2-amine
CID 117043979
[(2,5-dimethylphenyl)methyl-methylamino]methanethiol
CID 115228030
4-[(2,5-dimethylphenyl)methyl-methylamino]cyclohexan-1-ol
CID 115149515
2-[[2-(2,5-dimethylphenyl)acetyl]-methylamino]acetic acid
CID 62538496

Frequently Asked Questions

What is the IUPAC name of cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol?
The IUPAC name of cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol (CID 145338686) is cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol.
What is the SMILES notation for cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol?
The canonical SMILES for cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol is C1CCCC1.CC.CO.Cc1ccc(C)c(CN(C)C=O)c1.
What is the InChIKey of cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol?
The InChIKey is SAZCODRLYJCJDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO.C5H10.C2H6.CH4O/c1-9-4-5-10(2)11(6-9)7-12(3)8-13;1-2-4-5-3-1;2*1-2/h4-6,8H,7H2,1-3H3;1-5H2;1-2H3;2H,1H3.
What are the key properties of cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol?
cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol has a molecular weight of 309.49 g/mol, XLogP of 4.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentane;N-[(2,5-dimethylphenyl)methyl]-N-methylformamide;ethane;methanol is sourced from PubChem (CID 145338686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).