N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide

C19H23N3O3 — CID 42932973

IUPACN-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide
SMILESCN(C)c1ccc(NC(=O)c2ccc(OCC3CCCO3)cc2)cn1
InChIInChI=1S/C19H23N3O3/c1-22(2)18-10-7-15(12-20-18)21-19(23)14-5-8-16(9-6-14)25-13-17-4-3-11-24-17/h5-10,12,17H,3-4,11,13H2,1-2H3,(H,21,23)
InChIKeyFYSHKSRCXNTVCG-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.96
Rot. Bonds6

About N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide

N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide (PubChem CID 42932973) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide
PubChem CID42932973
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide
SMILESCN(C)c1ccc(NC(=O)c2ccc(OCC3CCCO3)cc2)cn1
InChIInChI=1S/C19H23N3O3/c1-22(2)18-10-7-15(12-20-18)21-19(23)14-5-8-16(9-6-14)25-13-17-4-3-11-24-17/h5-10,12,17H,3-4,11,13H2,1-2H3,(H,21,23)
InChIKeyFYSHKSRCXNTVCG-UHFFFAOYSA-N
XLogP2.96
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-methoxyethoxy)-N-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]benzamide
CID 40796712
N-(4-acetamidophenyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 40642293
4-methyl-N-[4-(oxolan-2-ylmethoxy)phenyl]benzamide
CID 4957909
methyl 4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzoate
CID 17222269
N-(3,4-dimethylphenyl)-4-[[(2S)-oxolan-2-yl]methoxy]benzamide
CID 42580258
N-[4-[[(2R)-oxolan-2-yl]methoxy]phenyl]pyridine-4-carboxamide
CID 7447165
4-[[4-(oxolan-2-ylmethoxy)benzoyl]amino]benzamide
CID 4786441
4-(2-ethoxyethoxy)-N-[4-(oxolan-2-ylmethoxy)phenyl]benzamide
CID 17112691
N-[4-(methanesulfonamido)phenyl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 36818148
4-[[(2S)-oxolan-2-yl]methoxy]-N-(6-pyrazol-1-yl-3-pyridinyl)benzamide
CID 25333571
N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]-4-phenylbenzamide
CID 9294955
N-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 52518675

Frequently Asked Questions

What is the IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide?
The IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide (CID 42932973) is N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide.
What is the SMILES notation for N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide?
The canonical SMILES for N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide is CN(C)c1ccc(NC(=O)c2ccc(OCC3CCCO3)cc2)cn1.
What is the InChIKey of N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide?
The InChIKey is FYSHKSRCXNTVCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-22(2)18-10-7-15(12-20-18)21-19(23)14-5-8-16(9-6-14)25-13-17-4-3-11-24-17/h5-10,12,17H,3-4,11,13H2,1-2H3,(H,21,23).
What are the key properties of N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide?
N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide has a molecular weight of 341.41 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide is sourced from PubChem (CID 42932973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).