N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide

C25H27N3O3 — CID 46957652

IUPACN-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide
SMILESCOc1ccc(N(Cc2cccnc2)C(=O)c2ccc(CN3CCOCC3)cc2)cc1
InChIInChI=1S/C25H27N3O3/c1-30-24-10-8-23(9-11-24)28(19-21-3-2-12-26-17-21)25(29)22-6-4-20(5-7-22)18-27-13-15-31-16-14-27/h2-12,17H,13-16,18-19H2,1H3
InChIKeyUVVIFVRPUATBHC-UHFFFAOYSA-N
MW417.51 g/mol
LogP3.77
Rot. Bonds7

About N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide

N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 46957652) has the molecular formula C25H27N3O3 and a molecular weight of 417.51 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide
PubChem CID46957652
Molecular FormulaC25H27N3O3
Molecular Weight417.51 g/mol
Exact Mass417.21
IUPAC NameN-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide
SMILESCOc1ccc(N(Cc2cccnc2)C(=O)c2ccc(CN3CCOCC3)cc2)cc1
InChIInChI=1S/C25H27N3O3/c1-30-24-10-8-23(9-11-24)28(19-21-3-2-12-26-17-21)25(29)22-6-4-20(5-7-22)18-27-13-15-31-16-14-27/h2-12,17H,13-16,18-19H2,1H3
InChIKeyUVVIFVRPUATBHC-UHFFFAOYSA-N
XLogP3.77
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.51
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)-1,3-benzodioxole-5-carboxamide
CID 110360634
N-[(4-methoxyphenyl)methyl]-N-methyl-4-(morpholin-4-ylmethyl)benzamide
CID 8991176
N-(6-methoxy-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonyl-N-(pyridin-3-ylmethyl)benzamide
CID 43965826
N-(4-fluorophenyl)-2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 110360820
N-(4-fluorophenyl)-3-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 110360811
N-benzyl-N-(4-methoxyphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide
CID 134012327
phenyl N-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)carbamate
CID 110360643
3-chloro-N-(3-methoxyphenyl)-N-(pyridin-3-ylmethyl)benzamide
CID 110360522
N-(4-methoxyphenyl)-3-methyl-N-(pyridin-3-ylmethyl)butanamide
CID 110360592
N-(6-ethyl-1,3-benzothiazol-2-yl)-4-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 40508187
N-(4-methoxyphenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
CID 110360620
4-methoxy-N-(4-methoxy-7-methyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide
CID 40508358

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide (CID 46957652) is N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide is COc1ccc(N(Cc2cccnc2)C(=O)c2ccc(CN3CCOCC3)cc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is UVVIFVRPUATBHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N3O3/c1-30-24-10-8-23(9-11-24)28(19-21-3-2-12-26-17-21)25(29)22-6-4-20(5-7-22)18-27-13-15-31-16-14-27/h2-12,17H,13-16,18-19H2,1H3.
What are the key properties of N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide?
N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide has a molecular weight of 417.51 g/mol, XLogP of 3.77, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-(morpholin-4-ylmethyl)-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 46957652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).