N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide

C24H25N3O3 — CID 18283258

IUPACN-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide
SMILESO=C(NCc1ccc(N2CCOCC2)nc1)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C24H25N3O3/c28-24(21-7-4-8-22(15-21)30-18-19-5-2-1-3-6-19)26-17-20-9-10-23(25-16-20)27-11-13-29-14-12-27/h1-10,15-16H,11-14,17-18H2,(H,26,28)
InChIKeyVYJJYESFLFPDQY-UHFFFAOYSA-N
MW403.48 g/mol
LogP3.43
Rot. Bonds7

About N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide

N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide (PubChem CID 18283258) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide
PubChem CID18283258
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC NameN-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide
SMILESO=C(NCc1ccc(N2CCOCC2)nc1)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C24H25N3O3/c28-24(21-7-4-8-22(15-21)30-18-19-5-2-1-3-6-19)26-17-20-9-10-23(25-16-20)27-11-13-29-14-12-27/h1-10,15-16H,11-14,17-18H2,(H,26,28)
InChIKeyVYJJYESFLFPDQY-UHFFFAOYSA-N
XLogP3.43
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide?
The IUPAC name of N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide (CID 18283258) is N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide.
What is the SMILES notation for N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide?
The canonical SMILES for N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide is O=C(NCc1ccc(N2CCOCC2)nc1)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide?
The InChIKey is VYJJYESFLFPDQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c28-24(21-7-4-8-22(15-21)30-18-19-5-2-1-3-6-19)26-17-20-9-10-23(25-16-20)27-11-13-29-14-12-27/h1-10,15-16H,11-14,17-18H2,(H,26,28).
What are the key properties of N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide?
N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide has a molecular weight of 403.48 g/mol, XLogP of 3.43, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-3-phenylmethoxybenzamide is sourced from PubChem (CID 18283258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).