1-(2-morpholin-4-ylphenyl)-3-propylurea

C14H21N3O2 — CID 110755134

IUPAC1-(2-morpholin-4-ylphenyl)-3-propylurea
SMILESCCCNC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C14H21N3O2/c1-2-7-15-14(18)16-12-5-3-4-6-13(12)17-8-10-19-11-9-17/h3-6H,2,7-11H2,1H3,(H2,15,16,18)
InChIKeyHQZSVEUDXBKXNU-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.05
Rot. Bonds4

About 1-(2-morpholin-4-ylphenyl)-3-propylurea

1-(2-morpholin-4-ylphenyl)-3-propylurea (PubChem CID 110755134) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylphenyl)-3-propylurea.

Molecular Properties

Compound Name1-(2-morpholin-4-ylphenyl)-3-propylurea
PubChem CID110755134
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name1-(2-morpholin-4-ylphenyl)-3-propylurea
SMILESCCCNC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C14H21N3O2/c1-2-7-15-14(18)16-12-5-3-4-6-13(12)17-8-10-19-11-9-17/h3-6H,2,7-11H2,1H3,(H2,15,16,18)
InChIKeyHQZSVEUDXBKXNU-UHFFFAOYSA-N
XLogP2.05
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-propyl-3-(2-pyrrolidin-1-ylphenyl)urea
CID 47107994
1-[2-(azepan-1-yl)phenyl]-3-propylurea
CID 47201899
1-[2-(2-ethylphenoxy)ethyl]-3-(2-morpholin-4-ylphenyl)urea
CID 112971778
1-(5-chloro-2-morpholin-4-ylphenyl)-3-propylurea
CID 47103076
1-[(2-methylphenyl)methyl]-3-(2-morpholin-4-ylphenyl)urea
CID 108897210
1-(2-cyclohexylethyl)-3-(2-morpholin-4-ylphenyl)urea
CID 108888594
1-(2-morpholin-4-ylphenyl)-3-pentan-3-ylurea
CID 108888338
1-[2-(2,6-dimethylphenoxy)ethyl]-3-(2-morpholin-4-ylphenyl)urea
CID 112973391
2-ethyl-N-(2-morpholin-4-ylphenyl)butanamide
CID 110756603
1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-3-propylurea
CID 94154582
2-methyl-N-(2-morpholin-4-ylphenyl)propanamide
CID 2767049
1-hexyl-3-(2-pyrrolidin-1-ylphenyl)urea
CID 52594776

Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylphenyl)-3-propylurea?
The IUPAC name of 1-(2-morpholin-4-ylphenyl)-3-propylurea (CID 110755134) is 1-(2-morpholin-4-ylphenyl)-3-propylurea.
What is the SMILES notation for 1-(2-morpholin-4-ylphenyl)-3-propylurea?
The canonical SMILES for 1-(2-morpholin-4-ylphenyl)-3-propylurea is CCCNC(=O)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 1-(2-morpholin-4-ylphenyl)-3-propylurea?
The InChIKey is HQZSVEUDXBKXNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-2-7-15-14(18)16-12-5-3-4-6-13(12)17-8-10-19-11-9-17/h3-6H,2,7-11H2,1H3,(H2,15,16,18).
What are the key properties of 1-(2-morpholin-4-ylphenyl)-3-propylurea?
1-(2-morpholin-4-ylphenyl)-3-propylurea has a molecular weight of 263.34 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylphenyl)-3-propylurea is sourced from PubChem (CID 110755134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).