N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide

C9H15FN2O — CID 165476129

IUPACN-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide
SMILESO=C(NCC1(F)CNC1)C1CCC1
InChIInChI=1S/C9H15FN2O/c10-9(4-11-5-9)6-12-8(13)7-2-1-3-7/h7,11H,1-6H2,(H,12,13)
InChIKeyOLRBPFQSCIHCMD-UHFFFAOYSA-N
MW186.23 g/mol
LogP0.21
Rot. Bonds3

About N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide

N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide (PubChem CID 165476129) has the molecular formula C9H15FN2O and a molecular weight of 186.23 g/mol. Its IUPAC name is N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide
PubChem CID165476129
Molecular FormulaC9H15FN2O
Molecular Weight186.23 g/mol
Exact Mass186.12
IUPAC NameN-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide
SMILESO=C(NCC1(F)CNC1)C1CCC1
InChIInChI=1S/C9H15FN2O/c10-9(4-11-5-9)6-12-8(13)7-2-1-3-7/h7,11H,1-6H2,(H,12,13)
InChIKeyOLRBPFQSCIHCMD-UHFFFAOYSA-N
XLogP0.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.23
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-methylcyclopropyl)methyl]cyclobutanecarboxamide
CID 127018359
N-[(1-aminocyclopentyl)methyl]cyclobutanecarboxamide
CID 164661339
N-[[1-(bromomethyl)cyclopropyl]methyl]cyclobutanecarboxamide
CID 115456256
4,4-difluoro-N-[(3-hydroxypyrrolidin-3-yl)methyl]cyclohexane-1-carboxamide
CID 114760533
N-[(4-methylpiperidin-4-yl)methyl]cycloheptanecarboxamide
CID 91660383
N-[[1-(2-bromoethyl)cyclopropyl]methyl]cyclobutanecarboxamide
CID 114758299
3,3-difluoro-N-[(3-hydroxypyrrolidin-3-yl)methyl]cyclopentane-1-carboxamide
CID 114226262
N-(chloromethyl)cyclobutanecarboxamide
CID 69083699
N-[(4-methylpiperidin-4-yl)methyl]cycloheptanecarboxamide;hydrochloride
CID 91660382
N-[(1-hydroxycyclohexyl)methyl]cycloheptanecarboxamide
CID 65114198
N-(2-hydroxyethyl)cyclobutanecarboxamide
CID 43389004
N-[[1-(hydroxymethyl)cyclopropyl]methyl]cyclooctanecarboxamide
CID 80717782

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide?
The IUPAC name of N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide (CID 165476129) is N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide.
What is the SMILES notation for N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide?
The canonical SMILES for N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide is O=C(NCC1(F)CNC1)C1CCC1.
What is the InChIKey of N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide?
The InChIKey is OLRBPFQSCIHCMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15FN2O/c10-9(4-11-5-9)6-12-8(13)7-2-1-3-7/h7,11H,1-6H2,(H,12,13).
What are the key properties of N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide?
N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide has a molecular weight of 186.23 g/mol, XLogP of 0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluoroazetidin-3-yl)methyl]cyclobutanecarboxamide is sourced from PubChem (CID 165476129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).