1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea

C20H25N3O3 — CID 27869107

IUPAC1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea
SMILESCOc1ccccc1NC(=O)NCc1ccccc1CN1CCOCC1
InChIInChI=1S/C20H25N3O3/c1-25-19-9-5-4-8-18(19)22-20(24)21-14-16-6-2-3-7-17(16)15-23-10-12-26-13-11-23/h2-9H,10-15H2,1H3,(H2,21,22,24)
InChIKeyZHYOIEPZNDZIKQ-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.85
Rot. Bonds6

About 1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea

1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea (PubChem CID 27869107) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea
PubChem CID27869107
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea
SMILESCOc1ccccc1NC(=O)NCc1ccccc1CN1CCOCC1
InChIInChI=1S/C20H25N3O3/c1-25-19-9-5-4-8-18(19)22-20(24)21-14-16-6-2-3-7-17(16)15-23-10-12-26-13-11-23/h2-9H,10-15H2,1H3,(H2,21,22,24)
InChIKeyZHYOIEPZNDZIKQ-UHFFFAOYSA-N
XLogP2.85
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea
CID 94516313
1-methoxy-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea
CID 47160584
(2S)-2-(2-methoxyphenoxy)-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]propanamide
CID 95706646
1-(4-chlorophenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea
CID 27869101
1-(3-ethyl-2-morpholin-4-ylpentyl)-3-(2-methoxyphenyl)urea
CID 24665000
1-(2-methoxyphenyl)-3-[(6-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 41430289
(2R)-N-(2-methoxyphenyl)-2-[4-(morpholin-4-ylmethyl)anilino]propanamide
CID 25355403
2-bromo-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 63679084
2-morpholin-4-ylethyl N-(2-methoxyphenyl)carbamate
CID 3087022
methyl 2-[4-[(2-methoxyphenyl)carbamoylamino]oxan-4-yl]acetate
CID 71851664
2-chloro-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]propanamide
CID 43346970
1-[(4-chlorophenyl)methyl]-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea
CID 36874306

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea?
The IUPAC name of 1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea (CID 27869107) is 1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea.
What is the SMILES notation for 1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea?
The canonical SMILES for 1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea is COc1ccccc1NC(=O)NCc1ccccc1CN1CCOCC1.
What is the InChIKey of 1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea?
The InChIKey is ZHYOIEPZNDZIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-25-19-9-5-4-8-18(19)22-20(24)21-14-16-6-2-3-7-17(16)15-23-10-12-26-13-11-23/h2-9H,10-15H2,1H3,(H2,21,22,24).
What are the key properties of 1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea?
1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea has a molecular weight of 355.44 g/mol, XLogP of 2.85, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-3-[[2-(morpholin-4-ylmethyl)phenyl]methyl]urea is sourced from PubChem (CID 27869107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).