3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide

C18H27NO2 — CID 90598691

IUPAC3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide
SMILESCOC(CNC(=O)CCC1CCCC1)c1ccccc1C
InChIInChI=1S/C18H27NO2/c1-14-7-3-6-10-16(14)17(21-2)13-19-18(20)12-11-15-8-4-5-9-15/h3,6-7,10,15,17H,4-5,8-9,11-13H2,1-2H3,(H,19,20)
InChIKeyBKDGGFRACPZWAD-UHFFFAOYSA-N
MW289.42 g/mol
LogP3.77
Rot. Bonds7

About 3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide

3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide (PubChem CID 90598691) has the molecular formula C18H27NO2 and a molecular weight of 289.42 g/mol. Its IUPAC name is 3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide
PubChem CID90598691
Molecular FormulaC18H27NO2
Molecular Weight289.42 g/mol
Exact Mass289.20
IUPAC Name3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide
SMILESCOC(CNC(=O)CCC1CCCC1)c1ccccc1C
InChIInChI=1S/C18H27NO2/c1-14-7-3-6-10-16(14)17(21-2)13-19-18(20)12-11-15-8-4-5-9-15/h3,6-7,10,15,17H,4-5,8-9,11-13H2,1-2H3,(H,19,20)
InChIKeyBKDGGFRACPZWAD-UHFFFAOYSA-N
XLogP3.77
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-methoxy-2-(2-methylphenyl)ethyl]cyclohexanecarboxamide
CID 90598682
N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,3-dimethylbutanamide
CID 90598675
1-[(2R)-2-methoxy-2-(2-methylphenyl)ethyl]-3-propan-2-ylurea
CID 97417874
N'-cyclopropyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]oxamide
CID 71810552
3-(2-fluorophenyl)-N-[(2R)-2-methoxy-2-(2-methylphenyl)ethyl]propanamide
CID 97417764
3-cyclopentyl-N-(2-methylpropyl)propanamide
CID 918369
N-(2-bromo-2-phenylethyl)-3-cyclohexylpropanamide
CID 114308467
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide
CID 90598726
1-[(2R)-2-methoxy-2-(2-methylphenyl)ethyl]-3-(2-methylphenyl)urea
CID 97417882
2-(4-ethoxyphenyl)-N-[2-methoxy-2-(2-methylphenyl)ethyl]acetamide
CID 90598744
N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide
CID 90598696
3-cyclohexyl-N-(2-hydroxy-2-phenylethyl)propanamide
CID 43391299

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide (CID 90598691) is 3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide is COC(CNC(=O)CCC1CCCC1)c1ccccc1C.
What is the InChIKey of 3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide?
The InChIKey is BKDGGFRACPZWAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO2/c1-14-7-3-6-10-16(14)17(21-2)13-19-18(20)12-11-15-8-4-5-9-15/h3,6-7,10,15,17H,4-5,8-9,11-13H2,1-2H3,(H,19,20).
What are the key properties of 3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide?
3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide has a molecular weight of 289.42 g/mol, XLogP of 3.77, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[2-methoxy-2-(2-methylphenyl)ethyl]propanamide is sourced from PubChem (CID 90598691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).