1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea

C19H19FN4O3 — CID 71086837

IUPAC1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea
SMILESCOc1ccc(C#N)cc1NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1F
InChIInChI=1S/C19H19FN4O3/c1-26-17-5-2-12(10-21)8-16(17)24-19(25)23-15-4-3-13(9-14(15)20)18-11-22-6-7-27-18/h2-5,8-9,18,22H,6-7,11H2,1H3,(H2,23,24,25)/t18-/m0/s1
InChIKeyIRARZHZSOOALQE-SFHVURJKSA-N
MW370.38 g/mol
LogP3.01
Rot. Bonds4

About 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea

1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea (PubChem CID 71086837) has the molecular formula C19H19FN4O3 and a molecular weight of 370.38 g/mol. Its IUPAC name is 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea.

Molecular Properties

Compound Name1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea
PubChem CID71086837
Molecular FormulaC19H19FN4O3
Molecular Weight370.38 g/mol
Exact Mass370.14
IUPAC Name1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea
SMILESCOc1ccc(C#N)cc1NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1F
InChIInChI=1S/C19H19FN4O3/c1-26-17-5-2-12(10-21)8-16(17)24-19(25)23-15-4-3-13(9-14(15)20)18-11-22-6-7-27-18/h2-5,8-9,18,22H,6-7,11H2,1H3,(H2,23,24,25)/t18-/m0/s1
InChIKeyIRARZHZSOOALQE-SFHVURJKSA-N
XLogP3.01
TPSA95.41 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.38
LogP ≤ 53.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea?
The IUPAC name of 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea (CID 71086837) is 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea.
What is the SMILES notation for 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea?
The canonical SMILES for 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea is COc1ccc(C#N)cc1NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1F.
What is the InChIKey of 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea?
The InChIKey is IRARZHZSOOALQE-SFHVURJKSA-N. The full InChI is InChI=1S/C19H19FN4O3/c1-26-17-5-2-12(10-21)8-16(17)24-19(25)23-15-4-3-13(9-14(15)20)18-11-22-6-7-27-18/h2-5,8-9,18,22H,6-7,11H2,1H3,(H2,23,24,25)/t18-/m0/s1.
What are the key properties of 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea?
1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea has a molecular weight of 370.38 g/mol, XLogP of 3.01, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyano-2-methoxyphenyl)-3-[2-fluoro-4-[(2R)-morpholin-2-yl]phenyl]urea is sourced from PubChem (CID 71086837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).