1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea

C14H20FN3O — CID 60895338

IUPAC1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea
SMILESO=C(NCCC1CCCNC1)Nc1ccccc1F
InChIInChI=1S/C14H20FN3O/c15-12-5-1-2-6-13(12)18-14(19)17-9-7-11-4-3-8-16-10-11/h1-2,5-6,11,16H,3-4,7-10H2,(H2,17,18,19)
InChIKeyKUNJUHNZHOFEIA-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.34
Rot. Bonds4

About 1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea

1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea (PubChem CID 60895338) has the molecular formula C14H20FN3O and a molecular weight of 265.33 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea
PubChem CID60895338
Molecular FormulaC14H20FN3O
Molecular Weight265.33 g/mol
Exact Mass265.16
IUPAC Name1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea
SMILESO=C(NCCC1CCCNC1)Nc1ccccc1F
InChIInChI=1S/C14H20FN3O/c15-12-5-1-2-6-13(12)18-14(19)17-9-7-11-4-3-8-16-10-11/h1-2,5-6,11,16H,3-4,7-10H2,(H2,17,18,19)
InChIKeyKUNJUHNZHOFEIA-UHFFFAOYSA-N
XLogP2.34
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chlorophenyl)-3-(2-piperidin-3-ylethyl)urea
CID 63628893
1-phenyl-3-(2-piperidin-3-ylethyl)urea
CID 60895337
1-N-(2-fluorophenyl)-3-N-(2-piperidin-3-ylethyl)piperidine-1,3-dicarboxamide
CID 119556343
2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119554934
2-[2-(2-fluoroanilino)-2-oxoethoxy]-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119557947
2,3,4-trifluoro-N-(2-piperidin-3-ylethyl)benzamide
CID 79749359
2-chloro-6-fluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119559044
2,3,5,6-tetrafluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555428
1-(2,6-difluorophenyl)-3-(piperidin-3-ylmethyl)urea;hydrochloride
CID 165430548
N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide
CID 60895336
2-(4-fluorophenyl)-N-(2-piperidin-3-ylethyl)acetamide
CID 60894094
N-[2-(2-fluorophenyl)ethyl]-2-piperidin-3-ylethanamine
CID 115211436

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea?
The IUPAC name of 1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea (CID 60895338) is 1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea.
What is the SMILES notation for 1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea?
The canonical SMILES for 1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea is O=C(NCCC1CCCNC1)Nc1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea?
The InChIKey is KUNJUHNZHOFEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O/c15-12-5-1-2-6-13(12)18-14(19)17-9-7-11-4-3-8-16-10-11/h1-2,5-6,11,16H,3-4,7-10H2,(H2,17,18,19).
What are the key properties of 1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea?
1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea has a molecular weight of 265.33 g/mol, XLogP of 2.34, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-(2-piperidin-3-ylethyl)urea is sourced from PubChem (CID 60895338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).