1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea

C15H19FN2O — CID 110469915

IUPAC1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea
SMILESO=C(NC1CC1)NC1(c2cccc(F)c2)CCCC1
InChIInChI=1S/C15H19FN2O/c16-12-5-3-4-11(10-12)15(8-1-2-9-15)18-14(19)17-13-6-7-13/h3-5,10,13H,1-2,6-9H2,(H2,17,18,19)
InChIKeyDIQDYKVXSJNMKI-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.06
Rot. Bonds3

About 1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea

1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea (PubChem CID 110469915) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is 1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea.

Molecular Properties

Compound Name1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea
PubChem CID110469915
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea
SMILESO=C(NC1CC1)NC1(c2cccc(F)c2)CCCC1
InChIInChI=1S/C15H19FN2O/c16-12-5-3-4-11(10-12)15(8-1-2-9-15)18-14(19)17-13-6-7-13/h3-5,10,13H,1-2,6-9H2,(H2,17,18,19)
InChIKeyDIQDYKVXSJNMKI-UHFFFAOYSA-N
XLogP3.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

4-[[1-(3-fluorophenyl)cyclopropyl]carbamoylamino]cyclohexane-1-carboxylic acid
CID 122023436
1-carbamoyl-3-[1-(3-fluorophenyl)cyclopentyl]urea
CID 110469918
1-[1-(3-aminophenyl)cyclopropyl]-3-cyclopropylurea
CID 110490977
N-(4-aminocyclohexyl)-1-(3-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119474298
1-(3-fluorophenyl)-N-(4-hydroxycyclohexyl)cyclobutane-1-carboxamide
CID 110884708
(E)-N-[1-(3-fluorophenyl)cyclopropyl]but-2-enamide
CID 110478087
N-[1-(3-fluorophenyl)cyclopropyl]piperidine-2-carboxamide
CID 110482396
1-[(3R)-1,1-dioxothiolan-3-yl]-3-[1-(4-fluorophenyl)cyclobutyl]urea
CID 95307173
1-cyclopropyl-3-[(3-fluorophenyl)methyl]urea
CID 47171959
N-[1-(3-fluorophenyl)cyclopropyl]-2,2-dimethylpropanamide
CID 110479683
2-chloro-N-[1-(3-fluorophenyl)cyclopropyl]acetamide
CID 166403981
1-cyclopropyl-3-[1-(2-fluorophenyl)cyclopropyl]urea
CID 110469627

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea?
The IUPAC name of 1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea (CID 110469915) is 1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea.
What is the SMILES notation for 1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea?
The canonical SMILES for 1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea is O=C(NC1CC1)NC1(c2cccc(F)c2)CCCC1.
What is the InChIKey of 1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea?
The InChIKey is DIQDYKVXSJNMKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c16-12-5-3-4-11(10-12)15(8-1-2-9-15)18-14(19)17-13-6-7-13/h3-5,10,13H,1-2,6-9H2,(H2,17,18,19).
What are the key properties of 1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea?
1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea has a molecular weight of 262.33 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[1-(3-fluorophenyl)cyclopentyl]urea is sourced from PubChem (CID 110469915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).