N-cyclobutylformamide;methanol

C6H13NO2 — CID 142523729

IUPACN-cyclobutylformamide;methanol
SMILESCO.O=CNC1CCC1
InChIInChI=1S/C5H9NO.CH4O/c7-4-6-5-2-1-3-5;1-2/h4-5H,1-3H2,(H,6,7);2H,1H3
InChIKeyOTFJEDMGOSSJMZ-UHFFFAOYSA-N
MW131.18 g/mol
LogP-0.11
Rot. Bonds2

About N-cyclobutylformamide;methanol

N-cyclobutylformamide;methanol (PubChem CID 142523729) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is N-cyclobutylformamide;methanol.

Molecular Properties

Compound NameN-cyclobutylformamide;methanol
PubChem CID142523729
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC NameN-cyclobutylformamide;methanol
SMILESCO.O=CNC1CCC1
InChIInChI=1S/C5H9NO.CH4O/c7-4-6-5-2-1-3-5;1-2/h4-5H,1-3H2,(H,6,7);2H,1H3
InChIKeyOTFJEDMGOSSJMZ-UHFFFAOYSA-N
XLogP-0.11
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexylformamide;ethane
CID 143536975
sodium;N-cyclohexylformamide;hydride
CID 173020638
ethane;N-(3-methylcyclohexyl)formamide
CID 145231025
(3-formamidocyclohexyl)boronic acid
CID 87651069
N-[5-(2-methylbutanoyl)cyclooctyl]formamide
CID 170223710
ethane;N-piperidin-4-ylformamide
CID 142035291
N-cyclohexylformamide;1-phenylethanone
CID 174611681
methyl 4-formamidocyclohexane-1-carboxylate
CID 89096292
N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)formamide
CID 65471104
N-cyclooct-3-en-1-ylformamide
CID 163931375
fluoromethane;N-piperidin-4-ylformamide
CID 144898161
N-[(1S,2S)-2-hydroxycyclopentyl]formamide
CID 57089664

Frequently Asked Questions

What is the IUPAC name of N-cyclobutylformamide;methanol?
The IUPAC name of N-cyclobutylformamide;methanol (CID 142523729) is N-cyclobutylformamide;methanol.
What is the SMILES notation for N-cyclobutylformamide;methanol?
The canonical SMILES for N-cyclobutylformamide;methanol is CO.O=CNC1CCC1.
What is the InChIKey of N-cyclobutylformamide;methanol?
The InChIKey is OTFJEDMGOSSJMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO.CH4O/c7-4-6-5-2-1-3-5;1-2/h4-5H,1-3H2,(H,6,7);2H,1H3.
What are the key properties of N-cyclobutylformamide;methanol?
N-cyclobutylformamide;methanol has a molecular weight of 131.18 g/mol, XLogP of -0.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutylformamide;methanol is sourced from PubChem (CID 142523729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).