1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea

C16H21N5O4 — CID 53468492

IUPAC1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea
SMILESCOc1ccc2[nH]cc(NC(=O)NCCN3CCOCC3)c(=O)c2n1
InChIInChI=1S/C16H21N5O4/c1-24-13-3-2-11-14(20-13)15(22)12(10-18-11)19-16(23)17-4-5-21-6-8-25-9-7-21/h2-3,10H,4-9H2,1H3,(H,18,22)(H2,17,19,23)
InChIKeyAMRWCNSVTAIHDI-UHFFFAOYSA-N
MW347.38 g/mol
LogP0.39
Rot. Bonds5

About 1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea

1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea (PubChem CID 53468492) has the molecular formula C16H21N5O4 and a molecular weight of 347.38 g/mol. Its IUPAC name is 1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea.

Molecular Properties

Compound Name1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea
PubChem CID53468492
Molecular FormulaC16H21N5O4
Molecular Weight347.38 g/mol
Exact Mass347.16
IUPAC Name1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea
SMILESCOc1ccc2[nH]cc(NC(=O)NCCN3CCOCC3)c(=O)c2n1
InChIInChI=1S/C16H21N5O4/c1-24-13-3-2-11-14(20-13)15(22)12(10-18-11)19-16(23)17-4-5-21-6-8-25-9-7-21/h2-3,10H,4-9H2,1H3,(H,18,22)(H2,17,19,23)
InChIKeyAMRWCNSVTAIHDI-UHFFFAOYSA-N
XLogP0.39
TPSA108.58 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 50.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea?
The IUPAC name of 1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea (CID 53468492) is 1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea.
What is the SMILES notation for 1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea?
The canonical SMILES for 1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea is COc1ccc2[nH]cc(NC(=O)NCCN3CCOCC3)c(=O)c2n1.
What is the InChIKey of 1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea?
The InChIKey is AMRWCNSVTAIHDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O4/c1-24-13-3-2-11-14(20-13)15(22)12(10-18-11)19-16(23)17-4-5-21-6-8-25-9-7-21/h2-3,10H,4-9H2,1H3,(H,18,22)(H2,17,19,23).
What are the key properties of 1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea?
1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea has a molecular weight of 347.38 g/mol, XLogP of 0.39, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-4-oxo-1H-1,5-naphthyridin-3-yl)-3-(2-morpholin-4-ylethyl)urea is sourced from PubChem (CID 53468492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).