1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea

C17H27N3O2 — CID 110403837

IUPAC1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea
SMILESCCCNC(=O)NCC(Cc1ccccc1)N1CCOCC1
InChIInChI=1S/C17H27N3O2/c1-2-8-18-17(21)19-14-16(20-9-11-22-12-10-20)13-15-6-4-3-5-7-15/h3-7,16H,2,8-14H2,1H3,(H2,18,19,21)
InChIKeyUKUODEMNQFHTIO-UHFFFAOYSA-N
MW305.42 g/mol
LogP1.64
Rot. Bonds7

About 1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea

1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea (PubChem CID 110403837) has the molecular formula C17H27N3O2 and a molecular weight of 305.42 g/mol. Its IUPAC name is 1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea.

Molecular Properties

Compound Name1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea
PubChem CID110403837
Molecular FormulaC17H27N3O2
Molecular Weight305.42 g/mol
Exact Mass305.21
IUPAC Name1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea
SMILESCCCNC(=O)NCC(Cc1ccccc1)N1CCOCC1
InChIInChI=1S/C17H27N3O2/c1-2-8-18-17(21)19-14-16(20-9-11-22-12-10-20)13-15-6-4-3-5-7-15/h3-7,16H,2,8-14H2,1H3,(H2,18,19,21)
InChIKeyUKUODEMNQFHTIO-UHFFFAOYSA-N
XLogP1.64
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

benzyl N-(2-morpholin-4-yl-3-phenylpropyl)carbamate
CID 110403830
1-benzyl-3-(3-phenyl-2-pyrrolidin-1-ylpropyl)urea
CID 110403915
N-(2-morpholin-4-yl-3-phenylpropyl)pyridine-2-carboxamide
CID 110665487
1-(oxan-4-yl)-3-(3-phenyl-2-piperidin-1-ylpropyl)urea
CID 110611113
1-[(2S)-3-(4-hydroxyphenyl)-2-pyrrolidin-1-ylpropyl]-3-(2-phenylethyl)urea;methane
CID 159423751
(2R)-2-morpholin-4-yl-3-phenylpropan-1-ol
CID 107861547
3-(4-methoxyphenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)butanamide
CID 110418357
N-(2-morpholin-4-yl-3-phenylpropyl)benzenesulfonamide
CID 110403847
2-cyclopropyl-2-(4-fluorophenyl)-N-(2-morpholin-4-yl-3-phenylpropyl)acetamide
CID 110420949
methyl N-(3-phenyl-2-piperidin-1-ylpropyl)carbamate
CID 110403986
3-acetamido-N-(3-phenyl-2-piperidin-1-ylpropyl)propanamide
CID 110420824
1-[2-(dimethylamino)-3-phenylpropyl]-3-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]urea
CID 78879846

Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea?
The IUPAC name of 1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea (CID 110403837) is 1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea.
What is the SMILES notation for 1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea?
The canonical SMILES for 1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea is CCCNC(=O)NCC(Cc1ccccc1)N1CCOCC1.
What is the InChIKey of 1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea?
The InChIKey is UKUODEMNQFHTIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O2/c1-2-8-18-17(21)19-14-16(20-9-11-22-12-10-20)13-15-6-4-3-5-7-15/h3-7,16H,2,8-14H2,1H3,(H2,18,19,21).
What are the key properties of 1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea?
1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea has a molecular weight of 305.42 g/mol, XLogP of 1.64, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-yl-3-phenylpropyl)-3-propylurea is sourced from PubChem (CID 110403837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).