1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea

C19H31N3O2 — CID 30749452

IUPAC1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea
SMILESCCC(CC)[C@H](CNC(=O)Nc1cccc(C)c1)N1CCOCC1
InChIInChI=1S/C19H31N3O2/c1-4-16(5-2)18(22-9-11-24-12-10-22)14-20-19(23)21-17-8-6-7-15(3)13-17/h6-8,13,16,18H,4-5,9-12,14H2,1-3H3,(H2,20,21,23)/t18-/m0/s1
InChIKeyWOZZXHZHLVTDIL-SFHVURJKSA-N
MW333.48 g/mol
LogP3.25
Rot. Bonds7

About 1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea

1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea (PubChem CID 30749452) has the molecular formula C19H31N3O2 and a molecular weight of 333.48 g/mol. Its IUPAC name is 1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea.

Molecular Properties

Compound Name1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea
PubChem CID30749452
Molecular FormulaC19H31N3O2
Molecular Weight333.48 g/mol
Exact Mass333.24
IUPAC Name1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea
SMILESCCC(CC)[C@H](CNC(=O)Nc1cccc(C)c1)N1CCOCC1
InChIInChI=1S/C19H31N3O2/c1-4-16(5-2)18(22-9-11-24-12-10-22)14-20-19(23)21-17-8-6-7-15(3)13-17/h6-8,13,16,18H,4-5,9-12,14H2,1-3H3,(H2,20,21,23)/t18-/m0/s1
InChIKeyWOZZXHZHLVTDIL-SFHVURJKSA-N
XLogP3.25
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.48
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-ethyl-2-morpholin-4-ylpentyl)-3-(4-fluorophenyl)urea
CID 24664998
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-(propan-2-ylcarbamoylamino)benzamide
CID 46439821
2-(3-ethyl-2-morpholin-4-ylpentyl)-1-(3-methylphenyl)guanidine;hydroiodide
CID 111041654
1-(3-ethyl-2-morpholin-4-ylpentyl)-3-(2-methoxyphenyl)urea
CID 24665000
N-[3-[[[N-(3-ethyl-2-morpholin-4-ylpentyl)-N'-methylcarbamimidoyl]amino]methyl]phenyl]butanamide
CID 111936249
1-[(5-bromothiophene-2-carbonyl)amino]-3-(3-ethyl-2-morpholin-4-ylpentyl)urea
CID 78887218
1-[1-(1-benzofuran-2-yl)ethyl]-3-(3-ethyl-2-morpholin-4-ylpentyl)urea
CID 46493943
1-(3-ethylphenyl)-3-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]urea
CID 86987253
5-bromo-2-chloro-N-(3-ethyl-2-morpholin-4-ylpentyl)benzamide
CID 43046378
1-(3-ethyl-2-morpholin-4-ylpentyl)-3-[(3-pyrazol-1-ylphenyl)methyl]urea
CID 86966875
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-(methylsulfinylmethyl)benzamide
CID 134053135
1-(3-methylphenyl)-3-(3-methyl-2-propan-2-ylbutyl)urea
CID 102916197

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea?
The IUPAC name of 1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea (CID 30749452) is 1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea.
What is the SMILES notation for 1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea?
The canonical SMILES for 1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea is CCC(CC)[C@H](CNC(=O)Nc1cccc(C)c1)N1CCOCC1.
What is the InChIKey of 1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea?
The InChIKey is WOZZXHZHLVTDIL-SFHVURJKSA-N. The full InChI is InChI=1S/C19H31N3O2/c1-4-16(5-2)18(22-9-11-24-12-10-22)14-20-19(23)21-17-8-6-7-15(3)13-17/h6-8,13,16,18H,4-5,9-12,14H2,1-3H3,(H2,20,21,23)/t18-/m0/s1.
What are the key properties of 1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea?
1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea has a molecular weight of 333.48 g/mol, XLogP of 3.25, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-3-ethyl-2-morpholin-4-ylpentyl]-3-(3-methylphenyl)urea is sourced from PubChem (CID 30749452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).