1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea

C16H23FN2O3 — CID 111509435

IUPAC1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea
SMILESCCCC1CC1NC(=O)NCC(O)COc1ccc(F)cc1
InChIInChI=1S/C16H23FN2O3/c1-2-3-11-8-15(11)19-16(21)18-9-13(20)10-22-14-6-4-12(17)5-7-14/h4-7,11,13,15,20H,2-3,8-10H2,1H3,(H2,18,19,21)
InChIKeyFNNUCWSSZNQYDH-UHFFFAOYSA-N
MW310.37 g/mol
LogP2.05
Rot. Bonds8

About 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea

1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea (PubChem CID 111509435) has the molecular formula C16H23FN2O3 and a molecular weight of 310.37 g/mol. Its IUPAC name is 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea.

Molecular Properties

Compound Name1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea
PubChem CID111509435
Molecular FormulaC16H23FN2O3
Molecular Weight310.37 g/mol
Exact Mass310.17
IUPAC Name1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea
SMILESCCCC1CC1NC(=O)NCC(O)COc1ccc(F)cc1
InChIInChI=1S/C16H23FN2O3/c1-2-3-11-8-15(11)19-16(21)18-9-13(20)10-22-14-6-4-12(17)5-7-14/h4-7,11,13,15,20H,2-3,8-10H2,1H3,(H2,18,19,21)
InChIKeyFNNUCWSSZNQYDH-UHFFFAOYSA-N
XLogP2.05
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.37
LogP ≤ 52.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]-2-methylbut-2-enamide
CID 111883336
2-amino-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]-2-methylpropanamide
CID 119304994
2-amino-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-methylpentanamide
CID 119751723
(Z)-3-cyclopropyl-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]but-2-enamide
CID 110912797
1-(2,5-dimethylphenyl)-3-[3-(4-fluorophenoxy)-2-hydroxypropyl]urea
CID 110903857
1-cyclopropyl-3-[2-hydroxy-3-[4-(trifluoromethyl)phenoxy]propyl]urea
CID 110904584
4-amino-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]pentanamide
CID 120561361
3-fluoro-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]-5-methylbenzamide
CID 111477313
2-(azepan-1-yl)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]propanamide
CID 111430757
methyl 2-[[3-(4-fluorophenoxy)-2-hydroxypropyl]amino]acetate
CID 60904479
1,3-bis(4-fluorophenoxy)propan-2-ol
CID 109412822
N-[3-(4-fluorophenoxy)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide
CID 111110931

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea?
The IUPAC name of 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea (CID 111509435) is 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea.
What is the SMILES notation for 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea?
The canonical SMILES for 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea is CCCC1CC1NC(=O)NCC(O)COc1ccc(F)cc1.
What is the InChIKey of 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea?
The InChIKey is FNNUCWSSZNQYDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O3/c1-2-3-11-8-15(11)19-16(21)18-9-13(20)10-22-14-6-4-12(17)5-7-14/h4-7,11,13,15,20H,2-3,8-10H2,1H3,(H2,18,19,21).
What are the key properties of 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea?
1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea has a molecular weight of 310.37 g/mol, XLogP of 2.05, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-fluorophenoxy)-2-hydroxypropyl]-3-(2-propylcyclopropyl)urea is sourced from PubChem (CID 111509435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).