2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide

C15H21NO3 — CID 111430199

IUPAC2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide
SMILESCOc1cccc(CNC(=O)CC2(O)CCCC2)c1
InChIInChI=1S/C15H21NO3/c1-19-13-6-4-5-12(9-13)11-16-14(17)10-15(18)7-2-3-8-15/h4-6,9,18H,2-3,7-8,10-11H2,1H3,(H,16,17)
InChIKeyIDFGDJWXJKMMPH-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.01
Rot. Bonds5

About 2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide

2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide (PubChem CID 111430199) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide
PubChem CID111430199
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide
SMILESCOc1cccc(CNC(=O)CC2(O)CCCC2)c1
InChIInChI=1S/C15H21NO3/c1-19-13-6-4-5-12(9-13)11-16-14(17)10-15(18)7-2-3-8-15/h4-6,9,18H,2-3,7-8,10-11H2,1H3,(H,16,17)
InChIKeyIDFGDJWXJKMMPH-UHFFFAOYSA-N
XLogP2.01
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1-hydroxycycloheptyl)methyl]-3-[(3-methoxyphenyl)methyl]urea
CID 111425507
2-(1-hydroxycyclohexyl)-N-[3-(3-methoxyphenyl)propyl]acetamide
CID 111537902
N-[(3-bromo-5-methoxyphenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 138024366
N-[(3-chlorophenyl)methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430252
N-[(1-hydroxycyclohexyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 64866121
N-[[3-[[ethyl(methyl)amino]methyl]phenyl]methyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111430735
2-chloro-N-[(3-methoxyphenyl)methyl]acetamide
CID 4839545
N-[(3-cyanophenyl)methyl]-2-(1-hydroxycyclohexyl)acetamide
CID 111520470
1-cyano-N-[(3-methoxyphenyl)methyl]cyclopentane-1-carboxamide
CID 47117713
N-[(3-methoxyphenyl)methyl]-2-(propan-2-ylamino)acetamide
CID 60683260
N-[(3-methoxyphenyl)methyl]-3-sulfanylpropanamide
CID 107023733
3-amino-N-[(3-methoxyphenyl)methyl]butanamide;hydrochloride
CID 119678228

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide (CID 111430199) is 2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide is COc1cccc(CNC(=O)CC2(O)CCCC2)c1.
What is the InChIKey of 2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide?
The InChIKey is IDFGDJWXJKMMPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-19-13-6-4-5-12(9-13)11-16-14(17)10-15(18)7-2-3-8-15/h4-6,9,18H,2-3,7-8,10-11H2,1H3,(H,16,17).
What are the key properties of 2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide?
2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide has a molecular weight of 263.34 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclopentyl)-N-[(3-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 111430199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).