3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide

C19H23ClN2O3 — CID 100782715

IUPAC3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide
SMILESCOCCOc1ccc(NC(=O)C(C)(C)Cc2ccc(Cl)cc2)cn1
InChIInChI=1S/C19H23ClN2O3/c1-19(2,12-14-4-6-15(20)7-5-14)18(23)22-16-8-9-17(21-13-16)25-11-10-24-3/h4-9,13H,10-12H2,1-3H3,(H,22,23)
InChIKeySRWLBIJJTBHFPG-UHFFFAOYSA-N
MW362.86 g/mol
LogP3.97
Rot. Bonds8

About 3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide

3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide (PubChem CID 100782715) has the molecular formula C19H23ClN2O3 and a molecular weight of 362.86 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide
PubChem CID100782715
Molecular FormulaC19H23ClN2O3
Molecular Weight362.86 g/mol
Exact Mass362.14
IUPAC Name3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide
SMILESCOCCOc1ccc(NC(=O)C(C)(C)Cc2ccc(Cl)cc2)cn1
InChIInChI=1S/C19H23ClN2O3/c1-19(2,12-14-4-6-15(20)7-5-14)18(23)22-16-8-9-17(21-13-16)25-11-10-24-3/h4-9,13H,10-12H2,1-3H3,(H,22,23)
InChIKeySRWLBIJJTBHFPG-UHFFFAOYSA-N
XLogP3.97
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.86
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide
CID 52698224
2-bromo-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylpropanamide
CID 100773616
2,2,3,3-tetrafluoro-N-[6-(2-methoxyethoxy)-3-pyridinyl]propanamide
CID 103732741
(2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide
CID 100774730
4-[(4-chlorophenyl)methyl]-N-[6-(2-methoxyethoxy)-3-pyridinyl]-1,4-diazepane-1-carboxamide
CID 55743349
3-(4-chlorophenyl)-N-(3,4-dimethoxyphenyl)-2,2-dimethylpropanamide
CID 100782698
4-chloro-N-[6-(2-methoxyethoxy)-3-pyridinyl]pyridine-3-carboxamide
CID 81228254
N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,4-dimethyl-2-propoxypentanamide
CID 133205857
N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-(methylamino)acetamide
CID 43704151
4-[[[6-(2-methoxyethoxy)-3-pyridinyl]amino]methyl]benzene-1,2-diol
CID 43688357
N-[6-(2-methoxyethoxy)-3-pyridinyl]-2H-triazole-4-carboxamide
CID 112733407
5-chloro-N-[6-(2-methoxyethoxy)-3-pyridinyl]pentanamide
CID 43697910

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide?
The IUPAC name of 3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide (CID 100782715) is 3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide is COCCOc1ccc(NC(=O)C(C)(C)Cc2ccc(Cl)cc2)cn1.
What is the InChIKey of 3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide?
The InChIKey is SRWLBIJJTBHFPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O3/c1-19(2,12-14-4-6-15(20)7-5-14)18(23)22-16-8-9-17(21-13-16)25-11-10-24-3/h4-9,13H,10-12H2,1-3H3,(H,22,23).
What are the key properties of 3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide?
3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide has a molecular weight of 362.86 g/mol, XLogP of 3.97, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 100782715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).