N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide

C16H26N2O3 — CID 133205912

IUPACN-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide
SMILESCCCCC(C)(OCCC)C(=O)Nc1ccc(OC)nc1
InChIInChI=1S/C16H26N2O3/c1-5-7-10-16(3,21-11-6-2)15(19)18-13-8-9-14(20-4)17-12-13/h8-9,12H,5-7,10-11H2,1-4H3,(H,18,19)
InChIKeyJXGNTOYHELSAHD-UHFFFAOYSA-N
MW294.39 g/mol
LogP3.40
Rot. Bonds9

About N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide

N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide (PubChem CID 133205912) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide
PubChem CID133205912
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC NameN-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide
SMILESCCCCC(C)(OCCC)C(=O)Nc1ccc(OC)nc1
InChIInChI=1S/C16H26N2O3/c1-5-7-10-16(3,21-11-6-2)15(19)18-13-8-9-14(20-4)17-12-13/h8-9,12H,5-7,10-11H2,1-4H3,(H,18,19)
InChIKeyJXGNTOYHELSAHD-UHFFFAOYSA-N
XLogP3.40
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyheptanamide
CID 133205936
(2S)-2-methyl-2-propoxy-N-(6-propoxy-3-pyridinyl)hexanamide
CID 100778007
2-methyl-2-propoxy-N-(6-propoxy-3-pyridinyl)hexanamide
CID 133205914
(2R)-N-(6-butoxy-3-pyridinyl)-2-methyl-2-propoxyheptanamide
CID 100778152
(2S)-N-(6-butoxy-3-pyridinyl)-2-ethoxy-2-methylhexanamide
CID 100776618
N-[6-(2-ethoxyethoxy)-3-pyridinyl]-2-methyl-2-propoxyheptanamide
CID 133205941
(2R)-2-ethoxy-2-methyl-N-(6-propoxy-3-pyridinyl)heptanamide
CID 100776755
N-(6-ethoxy-3-pyridinyl)-2-methyl-2-propoxypentanamide
CID 133205889
(2R)-2-methoxy-2-methyl-N-(6-propoxy-3-pyridinyl)heptanamide
CID 100774890
(2R)-N-(4-methoxyphenyl)-2-methyl-2-propoxyheptanamide
CID 100742668
(2R)-2-methoxy-N-[6-(2-methoxyethoxy)-3-pyridinyl]-2-methylhexanamide
CID 100774730
2-ethoxy-N-(6-ethoxy-3-pyridinyl)-2-methylheptanamide
CID 133205772

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide (CID 133205912) is N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide is CCCCC(C)(OCCC)C(=O)Nc1ccc(OC)nc1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide?
The InChIKey is JXGNTOYHELSAHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-5-7-10-16(3,21-11-6-2)15(19)18-13-8-9-14(20-4)17-12-13/h8-9,12H,5-7,10-11H2,1-4H3,(H,18,19).
What are the key properties of N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide?
N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide has a molecular weight of 294.39 g/mol, XLogP of 3.40, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-2-methyl-2-propoxyhexanamide is sourced from PubChem (CID 133205912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).