N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide

C13H17NO2 — CID 58053348

IUPACN-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide
SMILESCON(C)C(=O)C1CC(c2ccccc2)C1
InChIInChI=1S/C13H17NO2/c1-14(16-2)13(15)12-8-11(9-12)10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3
InChIKeyDIHYAOOWCXSOFC-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.20
Rot. Bonds3

About N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide

N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide (PubChem CID 58053348) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide
PubChem CID58053348
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC NameN-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide
SMILESCON(C)C(=O)C1CC(c2ccccc2)C1
InChIInChI=1S/C13H17NO2/c1-14(16-2)13(15)12-8-11(9-12)10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3
InChIKeyDIHYAOOWCXSOFC-UHFFFAOYSA-N
XLogP2.20
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[3-[methoxy(methyl)carbamoyl]cyclobutyl] benzoate
CID 176887704
benzene;N-methoxy-N-methylcyclopropanecarboxamide
CID 170770192
tert-butyl 2-[methoxy(methyl)carbamoyl]-4-phenylpyrrolidine-1-carboxylate
CID 76822292
N-methoxy-N-methyl-4-phenylpiperidine-1-carboxamide
CID 139678223
9-benzyl-N-methoxy-N-methyl-9-azabicyclo[3.3.1]nonane-3-carboxamide
CID 171950969
trans-(1S,2S)-2-benzoyl-N-methoxy-N-methylcyclopropane-1-carboxamide
CID 102245107
1-benzhydryl-N-methoxy-N-methylazetidine-3-carboxamide
CID 22506711
(3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide
CID 178194057
N-methoxy-N-methyl-4-phenylmethoxycyclohexane-1-carboxamide
CID 86642923
(2S,4S)-N-methoxy-N-methyl-2-phenyl-1,3-dioxane-4-carboxamide
CID 56647526
2-fluoro-N-methoxy-N-methyl-2-phenylcyclopropane-1-carboxamide
CID 123258315
1-(2-methoxyethyl)-N-methyl-5-oxo-N-(3-phenylcyclobutyl)pyrrolidine-3-carboxamide
CID 166281801

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide?
The IUPAC name of N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide (CID 58053348) is N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide.
What is the SMILES notation for N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide?
The canonical SMILES for N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide is CON(C)C(=O)C1CC(c2ccccc2)C1.
What is the InChIKey of N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide?
The InChIKey is DIHYAOOWCXSOFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-14(16-2)13(15)12-8-11(9-12)10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3.
What are the key properties of N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide?
N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide has a molecular weight of 219.28 g/mol, XLogP of 2.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-3-phenylcyclobutane-1-carboxamide is sourced from PubChem (CID 58053348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).