N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide

C22H29N3O3 — CID 55775479

IUPACN-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide
SMILESCC(C)C(CNC(=O)c1cccc(OCc2cccnc2)c1)N1CCOCC1
InChIInChI=1S/C22H29N3O3/c1-17(2)21(25-9-11-27-12-10-25)15-24-22(26)19-6-3-7-20(13-19)28-16-18-5-4-8-23-14-18/h3-8,13-14,17,21H,9-12,15-16H2,1-2H3,(H,24,26)
InChIKeyGNSQICDCWBVGFS-UHFFFAOYSA-N
MW383.49 g/mol
LogP2.75
Rot. Bonds8

About N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide

N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide (PubChem CID 55775479) has the molecular formula C22H29N3O3 and a molecular weight of 383.49 g/mol. Its IUPAC name is N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide
PubChem CID55775479
Molecular FormulaC22H29N3O3
Molecular Weight383.49 g/mol
Exact Mass383.22
IUPAC NameN-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide
SMILESCC(C)C(CNC(=O)c1cccc(OCc2cccnc2)c1)N1CCOCC1
InChIInChI=1S/C22H29N3O3/c1-17(2)21(25-9-11-27-12-10-25)15-24-22(26)19-6-3-7-20(13-19)28-16-18-5-4-8-23-14-18/h3-8,13-14,17,21H,9-12,15-16H2,1-2H3,(H,24,26)
InChIKeyGNSQICDCWBVGFS-UHFFFAOYSA-N
XLogP2.75
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.49
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methyl-2-morpholin-4-ylpentyl)-3-phenylmethoxybenzamide
CID 46540846
3-[(4-fluorophenyl)methoxy]-N-(2-morpholin-4-ylpropyl)benzamide
CID 55612328
N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]naphthalene-2-carboxamide
CID 25497917
N-(2-hydroxy-2,3-dimethylbutyl)-3-(pyridin-3-ylmethoxy)benzamide
CID 111483720
3-methoxy-N-(3-methyl-2-pyrrolidin-1-ylbutyl)benzamide
CID 110402974
N-[(1R)-1-cyano-2-methylpropyl]-3-(pyridin-3-ylmethoxy)benzamide
CID 86815583
3-ethoxy-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 55682964
N-(2-morpholin-4-ylethyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 47039155
N-(2-methyl-2-morpholin-4-ylpropyl)-4-(pyridin-3-ylmethoxy)benzamide
CID 30841499
N-[[4-(3-bromophenyl)oxan-4-yl]methyl]-3-(pyridin-3-ylmethoxy)benzamide
CID 55888749
N-methylsulfonyl-3-(pyridin-3-ylmethoxy)benzamide
CID 146154896
1-[3-(pyridin-3-ylmethoxy)phenyl]ethanone
CID 24704115

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide?
The IUPAC name of N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide (CID 55775479) is N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide.
What is the SMILES notation for N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide?
The canonical SMILES for N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide is CC(C)C(CNC(=O)c1cccc(OCc2cccnc2)c1)N1CCOCC1.
What is the InChIKey of N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide?
The InChIKey is GNSQICDCWBVGFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O3/c1-17(2)21(25-9-11-27-12-10-25)15-24-22(26)19-6-3-7-20(13-19)28-16-18-5-4-8-23-14-18/h3-8,13-14,17,21H,9-12,15-16H2,1-2H3,(H,24,26).
What are the key properties of N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide?
N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide has a molecular weight of 383.49 g/mol, XLogP of 2.75, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-morpholin-4-ylbutyl)-3-(pyridin-3-ylmethoxy)benzamide is sourced from PubChem (CID 55775479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).