N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide

C11H19FN2O — CID 67988113

IUPACN-cyclohexyl-3-fluoropyrrolidine-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCC(F)C1
InChIInChI=1S/C11H19FN2O/c12-9-6-7-14(8-9)11(15)13-10-4-2-1-3-5-10/h9-10H,1-8H2,(H,13,15)
InChIKeyHWEVYSLDIYAXKM-UHFFFAOYSA-N
MW214.28 g/mol
LogP2.07
Rot. Bonds1

About N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide

N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide (PubChem CID 67988113) has the molecular formula C11H19FN2O and a molecular weight of 214.28 g/mol. Its IUPAC name is N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-3-fluoropyrrolidine-1-carboxamide
PubChem CID67988113
Molecular FormulaC11H19FN2O
Molecular Weight214.28 g/mol
Exact Mass214.15
IUPAC NameN-cyclohexyl-3-fluoropyrrolidine-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCC(F)C1
InChIInChI=1S/C11H19FN2O/c12-9-6-7-14(8-9)11(15)13-10-4-2-1-3-5-10/h9-10H,1-8H2,(H,13,15)
InChIKeyHWEVYSLDIYAXKM-UHFFFAOYSA-N
XLogP2.07
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.28
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclohexyl-1-pyrrolidinecarboxamide
CID 327479
Urea, N'-cyclohexyl-N,N-dimethyl-
CID 4594662
(cyclohexylamino)-N-cyclopentylcarboxamide
CID 4469429
1-Cyclohexyl-2-imidazolidinone
CID 580352
3-Cyclohexyl-1,1-diethylurea
CID 4338720
3-Cyclohexyl-1,1-dipropylurea
CID 5093082
Urea, (1-cyclohexyl-3-pyrrolidinyl)-
CID 205686
N-(1-Cyclohexylpyrrolidin-3-yl)-N'-propan-2-ylcarbamimidic acid
CID 209545
3-Cyclohexyl-1,1-dibutylurea
CID 3398150
N,N-di-sec-butyl-N'-cyclohexylurea
CID 6467938
N-cyclohexyl(2-oxoimidazolidinyl)carboxamide
CID 679198
(4S)-1-cyclohexyl-4-propan-2-ylimidazolidin-2-one
CID 101965974

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide (CID 67988113) is N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide is O=C(NC1CCCCC1)N1CCC(F)C1.
What is the InChIKey of N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide?
The InChIKey is HWEVYSLDIYAXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19FN2O/c12-9-6-7-14(8-9)11(15)13-10-4-2-1-3-5-10/h9-10H,1-8H2,(H,13,15).
What are the key properties of N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide?
N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide has a molecular weight of 214.28 g/mol, XLogP of 2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-fluoropyrrolidine-1-carboxamide is sourced from PubChem (CID 67988113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).