5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one

C16H26N4O2 — CID 70780526

IUPAC5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one
SMILESCn1ncc(N2CCOC(CCNC3CCCC3)C2)cc1=O
InChIInChI=1S/C16H26N4O2/c1-19-16(21)10-14(11-18-19)20-8-9-22-15(12-20)6-7-17-13-4-2-3-5-13/h10-11,13,15,17H,2-9,12H2,1H3
InChIKeyLTYNEDQGCPRFLM-UHFFFAOYSA-N
MW306.41 g/mol
LogP0.91
Rot. Bonds5

About 5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one

5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one (PubChem CID 70780526) has the molecular formula C16H26N4O2 and a molecular weight of 306.41 g/mol. Its IUPAC name is 5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one.

Molecular Properties

Compound Name5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one
PubChem CID70780526
Molecular FormulaC16H26N4O2
Molecular Weight306.41 g/mol
Exact Mass306.21
IUPAC Name5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one
SMILESCn1ncc(N2CCOC(CCNC3CCCC3)C2)cc1=O
InChIInChI=1S/C16H26N4O2/c1-19-16(21)10-14(11-18-19)20-8-9-22-15(12-20)6-7-17-13-4-2-3-5-13/h10-11,13,15,17H,2-9,12H2,1H3
InChIKeyLTYNEDQGCPRFLM-UHFFFAOYSA-N
XLogP0.91
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one?
The IUPAC name of 5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one (CID 70780526) is 5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one.
What is the SMILES notation for 5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one?
The canonical SMILES for 5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one is Cn1ncc(N2CCOC(CCNC3CCCC3)C2)cc1=O.
What is the InChIKey of 5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one?
The InChIKey is LTYNEDQGCPRFLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O2/c1-19-16(21)10-14(11-18-19)20-8-9-22-15(12-20)6-7-17-13-4-2-3-5-13/h10-11,13,15,17H,2-9,12H2,1H3.
What are the key properties of 5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one?
5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one has a molecular weight of 306.41 g/mol, XLogP of 0.91, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[2-(cyclopentylamino)ethyl]morpholin-4-yl]-2-methylpyridazin-3-one is sourced from PubChem (CID 70780526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).