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

C23H25N3O3 — CID 113012586

IUPACN-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide
SMILESCCN(Cc1ccccc1)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)cn1
InChIInChI=1S/C23H25N3O3/c1-4-26(16-17-8-6-5-7-9-17)22-11-10-19(15-24-22)25-23(27)18-12-20(28-2)14-21(13-18)29-3/h5-15H,4,16H2,1-3H3,(H,25,27)
InChIKeyWYJKVMNSOFWLAP-UHFFFAOYSA-N
MW391.47 g/mol
LogP4.38
Rot. Bonds8

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

N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide (PubChem CID 113012586) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide
PubChem CID113012586
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC NameN-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide
SMILESCCN(Cc1ccccc1)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)cn1
InChIInChI=1S/C23H25N3O3/c1-4-26(16-17-8-6-5-7-9-17)22-11-10-19(15-24-22)25-23(27)18-12-20(28-2)14-21(13-18)29-3/h5-15H,4,16H2,1-3H3,(H,25,27)
InChIKeyWYJKVMNSOFWLAP-UHFFFAOYSA-N
XLogP4.38
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-4-methylbenzamide
CID 113012579
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
CID 113012596
5-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 109282890
2-[benzyl(ethyl)amino]-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 109171593
2-amino-N-[6-[benzyl(ethyl)amino]-3-pyridinyl]acetamide
CID 39181885
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-methylpropanamide
CID 113012566
N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide
CID 113022970
N-[6-(benzylamino)-3-pyridinyl]-3,5-dimethoxybenzamide
CID 113011445
1-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3-propan-2-ylurea
CID 113012624
N-[4-[benzyl(ethyl)amino]phenyl]-4-methoxybenzamide
CID 112982849
6-[benzyl(ethyl)amino]-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109157538
3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 2791610

Frequently Asked Questions

What is the IUPAC name of N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide?
The IUPAC name of N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide (CID 113012586) is N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide.
What is the SMILES notation for N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide?
The canonical SMILES for N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide is CCN(Cc1ccccc1)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)cn1.
What is the InChIKey of N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide?
The InChIKey is WYJKVMNSOFWLAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c1-4-26(16-17-8-6-5-7-9-17)22-11-10-19(15-24-22)25-23(27)18-12-20(28-2)14-21(13-18)29-3/h5-15H,4,16H2,1-3H3,(H,25,27).
What are the key properties of N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide?
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide has a molecular weight of 391.47 g/mol, XLogP of 4.38, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 113012586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).