1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea

C23H23N5O4 — CID 66971598

IUPAC1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea
SMILESO=C(NCc1ccccn1)Nc1cc(N2CC(COCc3ccccc3)OC2=O)ccn1
InChIInChI=1S/C23H23N5O4/c29-22(26-13-18-8-4-5-10-24-18)27-21-12-19(9-11-25-21)28-14-20(32-23(28)30)16-31-15-17-6-2-1-3-7-17/h1-12,20H,13-16H2,(H2,25,26,27,29)
InChIKeyPILAIYOLLUEKEM-UHFFFAOYSA-N
MW433.47 g/mol
LogP3.34
Rot. Bonds8

About 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea

1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea (PubChem CID 66971598) has the molecular formula C23H23N5O4 and a molecular weight of 433.47 g/mol. Its IUPAC name is 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea.

Molecular Properties

Compound Name1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea
PubChem CID66971598
Molecular FormulaC23H23N5O4
Molecular Weight433.47 g/mol
Exact Mass433.18
IUPAC Name1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea
SMILESO=C(NCc1ccccn1)Nc1cc(N2CC(COCc3ccccc3)OC2=O)ccn1
InChIInChI=1S/C23H23N5O4/c29-22(26-13-18-8-4-5-10-24-18)27-21-12-19(9-11-25-21)28-14-20(32-23(28)30)16-31-15-17-6-2-1-3-7-17/h1-12,20H,13-16H2,(H2,25,26,27,29)
InChIKeyPILAIYOLLUEKEM-UHFFFAOYSA-N
XLogP3.34
TPSA105.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.47
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea with MolForge

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Related Compounds

(5S)-3-phenyl-5-(phenylmethoxymethyl)-1,3-oxazolidin-2-one
CID 124582958
1-[4-[2-oxo-4-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea
CID 66971362
1-[(4-fluorophenyl)methyl]-3-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]urea
CID 58150117
N-[2-(pyridin-2-ylmethylcarbamoylamino)-4-pyridinyl]pyridine-2-carboxamide
CID 66971557
1-[3-(furan-2-ylmethoxymethyl)phenyl]-3-(pyridin-2-ylmethyl)urea
CID 51085457
1-(2-chloroethyl)-3-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]urea
CID 124636542
N-[[(5S)-3-(3-nitro-4-phenylmethoxyphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 57028429
5-[2-[2-[2-[2-[2-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]-3-phenyl-1,3-oxazolidin-2-one
CID 16754539
[15-(phenylmethoxymethyl)-5,16-dioxa-9,13-dithiadispiro[5.1.58.36]hexadecan-4-yl]methyl N-(pyridin-2-ylmethyl)carbamate
CID 25141363
1-benzyl-3-[4-(3,3-dimethyl-2-oxoindol-1-yl)-2-pyridinyl]urea
CID 66971371
N-benzyl-N'-(pyridin-2-ylmethyl)oxamide
CID 3109924
3-(3-methyl-2-oxo-1,3-oxazolidin-5-yl)-N-(pyridin-2-ylmethyl)propanamide
CID 110685355

Frequently Asked Questions

What is the IUPAC name of 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea?
The IUPAC name of 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea (CID 66971598) is 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea.
What is the SMILES notation for 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea?
The canonical SMILES for 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea is O=C(NCc1ccccn1)Nc1cc(N2CC(COCc3ccccc3)OC2=O)ccn1.
What is the InChIKey of 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea?
The InChIKey is PILAIYOLLUEKEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O4/c29-22(26-13-18-8-4-5-10-24-18)27-21-12-19(9-11-25-21)28-14-20(32-23(28)30)16-31-15-17-6-2-1-3-7-17/h1-12,20H,13-16H2,(H2,25,26,27,29).
What are the key properties of 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea?
1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea has a molecular weight of 433.47 g/mol, XLogP of 3.34, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[2-oxo-5-(phenylmethoxymethyl)-1,3-oxazolidin-3-yl]-2-pyridinyl]-3-(pyridin-2-ylmethyl)urea is sourced from PubChem (CID 66971598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).