N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide

C15H21NO3 — CID 91794448

IUPACN-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide
SMILESCOCC(=O)NC(Cc1ccccc1)C1CC(O)C1
InChIInChI=1S/C15H21NO3/c1-19-10-15(18)16-14(12-8-13(17)9-12)7-11-5-3-2-4-6-11/h2-6,12-14,17H,7-10H2,1H3,(H,16,18)
InChIKeyLOZCYISDUMBBPS-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.13
Rot. Bonds6

About N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide

N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide (PubChem CID 91794448) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide
PubChem CID91794448
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide
SMILESCOCC(=O)NC(Cc1ccccc1)C1CC(O)C1
InChIInChI=1S/C15H21NO3/c1-19-10-15(18)16-14(12-8-13(17)9-12)7-11-5-3-2-4-6-11/h2-6,12-14,17H,7-10H2,1H3,(H,16,18)
InChIKeyLOZCYISDUMBBPS-UHFFFAOYSA-N
XLogP1.13
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-1-(2-methoxyacetyl)piperidine-4-carboxamide
CID 91786060
2-(dimethylcarbamoylamino)-N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]acetamide
CID 91761784
2-[(2-methoxyacetyl)amino]-3-phenylpropanoic acid
CID 16774532
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-2-methoxyacetamide
CID 101173549
3-(2-amino-1,3-thiazol-4-yl)-N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]propanamide
CID 91762539
N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-6-oxo-1H-pyridine-3-carboxamide
CID 91788825
1-[(1R)-1-cyclopropyl-2-phenylethyl]-3-methoxyurea
CID 95632300
N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-5-methyl-1-propylpyrazole-4-carboxamide
CID 91781993
3-(2-fluorophenyl)-N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]propanamide
CID 91766999
N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]imidazo[1,2-a]pyridine-6-carboxamide
CID 91767171
N-[1-(3-hydroxycyclobutyl)-2-pyridin-4-ylethyl]-2-(1H-indol-3-yl)acetamide
CID 91777146
2-methoxy-N-[(1S)-1-phenylethyl]acetamide
CID 835320

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide?
The IUPAC name of N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide (CID 91794448) is N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide.
What is the SMILES notation for N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide?
The canonical SMILES for N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide is COCC(=O)NC(Cc1ccccc1)C1CC(O)C1.
What is the InChIKey of N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide?
The InChIKey is LOZCYISDUMBBPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-19-10-15(18)16-14(12-8-13(17)9-12)7-11-5-3-2-4-6-11/h2-6,12-14,17H,7-10H2,1H3,(H,16,18).
What are the key properties of N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide?
N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide has a molecular weight of 263.34 g/mol, XLogP of 1.13, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-hydroxycyclobutyl)-2-phenylethyl]-2-methoxyacetamide is sourced from PubChem (CID 91794448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).