1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea

C19H23N3O2 — CID 95238427

IUPAC1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea
SMILESC[C@@H](NC(=O)Nc1ccccc1)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C19H23N3O2/c1-15(20-19(23)21-17-5-3-2-4-6-17)16-7-9-18(10-8-16)22-11-13-24-14-12-22/h2-10,15H,11-14H2,1H3,(H2,20,21,23)/t15-/m1/s1
InChIKeyGTKMZWGMSRPZQV-OAHLLOKOSA-N
MW325.41 g/mol
LogP3.41
Rot. Bonds4

About 1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea

1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea (PubChem CID 95238427) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea.

Molecular Properties

Compound Name1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea
PubChem CID95238427
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea
SMILESC[C@@H](NC(=O)Nc1ccccc1)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C19H23N3O2/c1-15(20-19(23)21-17-5-3-2-4-6-17)16-7-9-18(10-8-16)22-11-13-24-14-12-22/h2-10,15H,11-14H2,1H3,(H2,20,21,23)/t15-/m1/s1
InChIKeyGTKMZWGMSRPZQV-OAHLLOKOSA-N
XLogP3.41
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

1-(3-acetylphenyl)-3-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]urea
CID 52509642
1-(4-morpholin-4-ylphenyl)-3-propan-2-ylurea
CID 47173524
2-[(3-methylphenyl)carbamoylamino]-N-[1-(4-morpholin-4-ylphenyl)ethyl]acetamide
CID 48681572
(2R)-N-[(1S)-1-(4-morpholin-4-ylphenyl)ethyl]-2-phenoxypropanamide
CID 95705953
1-[(1R)-1-(4-fluorophenyl)ethyl]-3-phenylurea
CID 27868374
(2S)-2-(benzenesulfonamido)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide
CID 48681424
1-phenyl-3-[1-(4-pyrrolidin-1-ylphenyl)ethyl]thiourea
CID 133216188
1-[(1R)-1-(4-methoxyphenyl)ethyl]-3-phenylurea
CID 28958845
N-[3-[1-[(4-piperidin-1-ylphenyl)carbamoylamino]ethyl]phenyl]acetamide
CID 55696566
1-[(4-morpholin-4-ylphenyl)methyl]-3-(4-propan-2-ylphenyl)urea
CID 86830614
1-[(1S)-1-(2,5-dimethylfuran-3-yl)ethyl]-3-(3-morpholin-4-ylphenyl)urea
CID 95130030
1-[1-(4-morpholin-4-ylphenyl)ethyl]-3-(3-propan-2-yloxyphenyl)thiourea
CID 133231041

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea?
The IUPAC name of 1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea (CID 95238427) is 1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea.
What is the SMILES notation for 1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea?
The canonical SMILES for 1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea is C[C@@H](NC(=O)Nc1ccccc1)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea?
The InChIKey is GTKMZWGMSRPZQV-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-15(20-19(23)21-17-5-3-2-4-6-17)16-7-9-18(10-8-16)22-11-13-24-14-12-22/h2-10,15H,11-14H2,1H3,(H2,20,21,23)/t15-/m1/s1.
What are the key properties of 1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea?
1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea has a molecular weight of 325.41 g/mol, XLogP of 3.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-(4-morpholin-4-ylphenyl)ethyl]-3-phenylurea is sourced from PubChem (CID 95238427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).