N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide

C23H25N3O3 — CID 113022970

IUPACN-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide
SMILESCCN(c1cccc(C)c1)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)cn1
InChIInChI=1S/C23H25N3O3/c1-5-26(19-8-6-7-16(2)11-19)22-10-9-18(15-24-22)25-23(27)17-12-20(28-3)14-21(13-17)29-4/h6-15H,5H2,1-4H3,(H,25,27)
InChIKeyDXBBGWSNALQHQH-UHFFFAOYSA-N
MW391.47 g/mol
LogP4.82
Rot. Bonds7

About N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide

N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide (PubChem CID 113022970) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide
PubChem CID113022970
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC NameN-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide
SMILESCCN(c1cccc(C)c1)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)cn1
InChIInChI=1S/C23H25N3O3/c1-5-26(19-8-6-7-16(2)11-19)22-10-9-18(15-24-22)25-23(27)17-12-20(28-3)14-21(13-17)29-4/h6-15H,5H2,1-4H3,(H,25,27)
InChIKeyDXBBGWSNALQHQH-UHFFFAOYSA-N
XLogP4.82
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide
CID 113022991
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide
CID 113012586
N-(3,4-dimethoxyphenyl)-2-(N-ethyl-3-methylanilino)pyrimidine-5-carboxamide
CID 109269982
6-(N-ethyl-3-methylanilino)pyridine-3-carboxylic acid
CID 61101859
2-(N-ethyl-3-methylanilino)-N-(4-methylphenyl)pyrimidine-5-carboxamide
CID 109265763
N-[6-(N-ethyl-3-methylanilino)pyridazin-3-yl]-3,4-dimethoxybenzamide
CID 113051420
N-(3-chloro-4-methoxyphenyl)-2-(N-ethyl-3-methylanilino)pyrimidine-5-carboxamide
CID 109269318
N-[4-(dimethylamino)phenyl]-5-(N-ethyl-3-methylanilino)pyrazine-2-carboxamide
CID 109294256
N-[6-(N-ethylanilino)-3-pyridinyl]-3,4-difluorobenzamide
CID 113017591
N-(3-chloro-4-methoxyphenyl)-5-(N-ethyl-3-methylanilino)pyridine-3-carboxamide
CID 109245017
3,5-dimethoxy-N-[4-(3-methylanilino)phenyl]benzamide
CID 112985952
N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]benzenesulfonamide
CID 113023014

Frequently Asked Questions

What is the IUPAC name of N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide?
The IUPAC name of N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide (CID 113022970) is N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide.
What is the SMILES notation for N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide?
The canonical SMILES for N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide is CCN(c1cccc(C)c1)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)cn1.
What is the InChIKey of N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide?
The InChIKey is DXBBGWSNALQHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c1-5-26(19-8-6-7-16(2)11-19)22-10-9-18(15-24-22)25-23(27)17-12-20(28-3)14-21(13-17)29-4/h6-15H,5H2,1-4H3,(H,25,27).
What are the key properties of N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide?
N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide has a molecular weight of 391.47 g/mol, XLogP of 4.82, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 113022970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).