N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide

C24H39N3O5 — CID 46060169

IUPACN-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide
SMILESCOCCN(CC1CN(CC(O)CN2CCCCC2)CCO1)C(=O)c1ccc(OC)cc1
InChIInChI=1S/C24H39N3O5/c1-30-14-13-27(24(29)20-6-8-22(31-2)9-7-20)19-23-18-26(12-15-32-23)17-21(28)16-25-10-4-3-5-11-25/h6-9,21,23,28H,3-5,10-19H2,1-2H3
InChIKeyGDARETBOYCSOJZ-UHFFFAOYSA-N
MW449.59 g/mol
LogP1.33
Rot. Bonds11

About N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide

N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide (PubChem CID 46060169) has the molecular formula C24H39N3O5 and a molecular weight of 449.59 g/mol. Its IUPAC name is N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound NameN-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide
PubChem CID46060169
Molecular FormulaC24H39N3O5
Molecular Weight449.59 g/mol
Exact Mass449.29
IUPAC NameN-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide
SMILESCOCCN(CC1CN(CC(O)CN2CCCCC2)CCO1)C(=O)c1ccc(OC)cc1
InChIInChI=1S/C24H39N3O5/c1-30-14-13-27(24(29)20-6-8-22(31-2)9-7-20)19-23-18-26(12-15-32-23)17-21(28)16-25-10-4-3-5-11-25/h6-9,21,23,28H,3-5,10-19H2,1-2H3
InChIKeyGDARETBOYCSOJZ-UHFFFAOYSA-N
XLogP1.33
TPSA74.71 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.59
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide?
The IUPAC name of N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide (CID 46060169) is N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide?
The canonical SMILES for N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide is COCCN(CC1CN(CC(O)CN2CCCCC2)CCO1)C(=O)c1ccc(OC)cc1.
What is the InChIKey of N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide?
The InChIKey is GDARETBOYCSOJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H39N3O5/c1-30-14-13-27(24(29)20-6-8-22(31-2)9-7-20)19-23-18-26(12-15-32-23)17-21(28)16-25-10-4-3-5-11-25/h6-9,21,23,28H,3-5,10-19H2,1-2H3.
What are the key properties of N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide?
N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide has a molecular weight of 449.59 g/mol, XLogP of 1.33, 11 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-hydroxy-3-piperidin-1-ylpropyl)morpholin-2-yl]methyl]-4-methoxy-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 46060169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).