1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one

C9H15FN2O — CID 134169330

IUPAC1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one
SMILESO=C1NCCN1[C@H]1CCCC[C@H]1F
InChIInChI=1S/C9H15FN2O/c10-7-3-1-2-4-8(7)12-6-5-11-9(12)13/h7-8H,1-6H2,(H,11,13)/t7-,8+/m1/s1
InChIKeyGYMBEMXWCZWVKN-SFYZADRCSA-N
MW186.23 g/mol
LogP1.29
Rot. Bonds1

About 1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one

1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one (PubChem CID 134169330) has the molecular formula C9H15FN2O and a molecular weight of 186.23 g/mol. Its IUPAC name is 1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one
PubChem CID134169330
Molecular FormulaC9H15FN2O
Molecular Weight186.23 g/mol
Exact Mass186.12
IUPAC Name1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one
SMILESO=C1NCCN1[C@H]1CCCC[C@H]1F
InChIInChI=1S/C9H15FN2O/c10-7-3-1-2-4-8(7)12-6-5-11-9(12)13/h7-8H,1-6H2,(H,11,13)/t7-,8+/m1/s1
InChIKeyGYMBEMXWCZWVKN-SFYZADRCSA-N
XLogP1.29
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.23
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclohexyl-1-pyrrolidinecarboxamide
CID 327479
N-[2-(diethylamino)ethyl](cyclohexylamino)carboxamide
CID 2054543
1-Cyclohexyl-2-imidazolidinone
CID 580352
Urea, (1-cyclohexyl-3-pyrrolidinyl)-
CID 205686
N-(1-Cyclohexylpyrrolidin-3-yl)-N'-propan-2-ylcarbamimidic acid
CID 209545
1-(Piperidin-3-yl)imidazolidin-2-one
CID 45791720
3,3-Dimethyl-1-((1-methylpyrrolidin-2-yl)methyl)urea
CID 110470360
N-cyclohexyl(2-oxoimidazolidinyl)carboxamide
CID 679198
(4S)-1-cyclohexyl-4-propan-2-ylimidazolidin-2-one
CID 101965974
1-cyclohexyl-3-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]urea
CID 95707249
1,1-diethyl-3-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]urea
CID 97786807
1-(Piperidin-4-yl)imidazolidin-2-one
CID 13031757

Frequently Asked Questions

What is the IUPAC name of 1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one?
The IUPAC name of 1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one (CID 134169330) is 1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one.
What is the SMILES notation for 1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one?
The canonical SMILES for 1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one is O=C1NCCN1[C@H]1CCCC[C@H]1F.
What is the InChIKey of 1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one?
The InChIKey is GYMBEMXWCZWVKN-SFYZADRCSA-N. The full InChI is InChI=1S/C9H15FN2O/c10-7-3-1-2-4-8(7)12-6-5-11-9(12)13/h7-8H,1-6H2,(H,11,13)/t7-,8+/m1/s1.
What are the key properties of 1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one?
1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one has a molecular weight of 186.23 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1S,2R)-2-fluorocyclohexyl]imidazolidin-2-one is sourced from PubChem (CID 134169330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).