N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide

C17H23FN2O — CID 119310492

IUPACN-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide
SMILESO=C(NCC1(c2ccc(F)cc2)CCC1)C1CCNCC1
InChIInChI=1S/C17H23FN2O/c18-15-4-2-14(3-5-15)17(8-1-9-17)12-20-16(21)13-6-10-19-11-7-13/h2-5,13,19H,1,6-12H2,(H,20,21)
InChIKeyXBQQFLMFQLWMEZ-UHFFFAOYSA-N
MW290.38 g/mol
LogP2.36
Rot. Bonds4

About N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide

N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide (PubChem CID 119310492) has the molecular formula C17H23FN2O and a molecular weight of 290.38 g/mol. Its IUPAC name is N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide
PubChem CID119310492
Molecular FormulaC17H23FN2O
Molecular Weight290.38 g/mol
Exact Mass290.18
IUPAC NameN-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide
SMILESO=C(NCC1(c2ccc(F)cc2)CCC1)C1CCNCC1
InChIInChI=1S/C17H23FN2O/c18-15-4-2-14(3-5-15)17(8-1-9-17)12-20-16(21)13-6-10-19-11-7-13/h2-5,13,19H,1,6-12H2,(H,20,21)
InChIKeyXBQQFLMFQLWMEZ-UHFFFAOYSA-N
XLogP2.36
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.38
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-phenylcyclopentyl)methyl]piperidine-4-carboxamide
CID 119275845
N-[[1-(4-fluorophenyl)cyclopentyl]methyl]piperidine-3-carboxamide
CID 119293577
N-[[1-(4-fluorophenyl)cyclopentyl]methyl]piperidine-3-carboxamide;hydrochloride
CID 119293576
N-[(1-phenylcyclobutyl)methyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119699128
N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-2-carboxamide
CID 119310485
N-[[1-(4-chlorophenyl)cyclopentyl]methyl]pyrrolidine-3-carboxamide
CID 119749968
N-[[1-(4-fluorophenyl)cyclohexyl]methyl]pyrrolidine-2-carboxamide
CID 119303685
N-[[4-(4-fluorophenyl)oxan-4-yl]methyl]piperidine-3-carboxamide;hydrochloride
CID 119303720
N-[[1-(4-fluorophenyl)cyclobutyl]methyl]morpholine-2-carboxamide;hydrochloride
CID 119761194
N-[[1-(4-fluorophenyl)cyclobutyl]methyl]morpholine-3-carboxamide;hydrochloride
CID 119761154
1-benzylsulfonyl-N-[[1-(4-fluorophenyl)cyclopentyl]methyl]piperidine-4-carboxamide
CID 55781036
N-[[1-(3-fluorophenyl)cyclopropyl]methyl]piperidine-3-carboxamide
CID 110482446

Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide?
The IUPAC name of N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide (CID 119310492) is N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide?
The canonical SMILES for N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide is O=C(NCC1(c2ccc(F)cc2)CCC1)C1CCNCC1.
What is the InChIKey of N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide?
The InChIKey is XBQQFLMFQLWMEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O/c18-15-4-2-14(3-5-15)17(8-1-9-17)12-20-16(21)13-6-10-19-11-7-13/h2-5,13,19H,1,6-12H2,(H,20,21).
What are the key properties of N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide?
N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide has a molecular weight of 290.38 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-4-carboxamide is sourced from PubChem (CID 119310492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).