N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide

C25H27N3O2 — CID 43068945

IUPACN-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide
SMILESCC1CN(c2ccc(C(=O)Nc3ccccc3Cc3ccccc3)cn2)CC(C)O1
InChIInChI=1S/C25H27N3O2/c1-18-16-28(17-19(2)30-18)24-13-12-22(15-26-24)25(29)27-23-11-7-6-10-21(23)14-20-8-4-3-5-9-20/h3-13,15,18-19H,14,16-17H2,1-2H3,(H,27,29)
InChIKeyRYLDZPAIBWBMGJ-UHFFFAOYSA-N
MW401.51 g/mol
LogP4.54
Rot. Bonds5

About N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide

N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide (PubChem CID 43068945) has the molecular formula C25H27N3O2 and a molecular weight of 401.51 g/mol. Its IUPAC name is N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide
PubChem CID43068945
Molecular FormulaC25H27N3O2
Molecular Weight401.51 g/mol
Exact Mass401.21
IUPAC NameN-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide
SMILESCC1CN(c2ccc(C(=O)Nc3ccccc3Cc3ccccc3)cn2)CC(C)O1
InChIInChI=1S/C25H27N3O2/c1-18-16-28(17-19(2)30-18)24-13-12-22(15-26-24)25(29)27-23-11-7-6-10-21(23)14-20-8-4-3-5-9-20/h3-13,15,18-19H,14,16-17H2,1-2H3,(H,27,29)
InChIKeyRYLDZPAIBWBMGJ-UHFFFAOYSA-N
XLogP4.54
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.51
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-[2-(2-ethylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 37319435
6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2,4-dimethylphenyl)pyridine-3-carboxamide
CID 37317252
N-benzhydryl-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide
CID 43071668
N-(2-benzylphenyl)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]acetamide
CID 8900246
6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-propan-2-ylpyridine-3-carboxamide
CID 37319485
N'-(2-chlorobenzoyl)-6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]pyridine-3-carbohydrazide
CID 94146461
6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N'-(4-methylbenzoyl)pyridine-3-carbohydrazide
CID 37319446
6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 39898275
N-(2-aminophenyl)-6-(3,5-dimethylpiperazin-1-yl)pyridine-3-carboxamide
CID 69085241
N-(2-benzylphenyl)-1-methylpyrazole-4-carboxamide
CID 35294770
6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-[2-(4-hydroxyphenyl)ethyl]pyridine-3-carboxamide
CID 94526475
1-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-3-[[6-(2,6-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]urea
CID 55702055

Frequently Asked Questions

What is the IUPAC name of N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide?
The IUPAC name of N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide (CID 43068945) is N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide is CC1CN(c2ccc(C(=O)Nc3ccccc3Cc3ccccc3)cn2)CC(C)O1.
What is the InChIKey of N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide?
The InChIKey is RYLDZPAIBWBMGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N3O2/c1-18-16-28(17-19(2)30-18)24-13-12-22(15-26-24)25(29)27-23-11-7-6-10-21(23)14-20-8-4-3-5-9-20/h3-13,15,18-19H,14,16-17H2,1-2H3,(H,27,29).
What are the key properties of N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide?
N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide has a molecular weight of 401.51 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzylphenyl)-6-(2,6-dimethylmorpholin-4-yl)pyridine-3-carboxamide is sourced from PubChem (CID 43068945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).