N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide

C16H24N2O4 — CID 71707660

IUPACN-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide
SMILESCOc1cn(CC(=O)NC2CCCCCC2)c(CO)cc1=O
InChIInChI=1S/C16H24N2O4/c1-22-15-9-18(13(11-19)8-14(15)20)10-16(21)17-12-6-4-2-3-5-7-12/h8-9,12,19H,2-7,10-11H2,1H3,(H,17,21)
InChIKeyYCSWVDGXPLKUHD-UHFFFAOYSA-N
MW308.38 g/mol
LogP1.19
Rot. Bonds5

About N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide

N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide (PubChem CID 71707660) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide
PubChem CID71707660
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC NameN-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide
SMILESCOc1cn(CC(=O)NC2CCCCCC2)c(CO)cc1=O
InChIInChI=1S/C16H24N2O4/c1-22-15-9-18(13(11-19)8-14(15)20)10-16(21)17-12-6-4-2-3-5-7-12/h8-9,12,19H,2-7,10-11H2,1H3,(H,17,21)
InChIKeyYCSWVDGXPLKUHD-UHFFFAOYSA-N
XLogP1.19
TPSA80.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclohexyl-2-(2-(hydroxymethyl)-5-methoxy-4-oxopyridin-1(4H)-yl)acetamide
CID 16853183
N-cyclooctyl-2-(2-(hydroxymethyl)-5-methoxy-4-oxopyridin-1(4H)-yl)acetamide
CID 71705754
N-cyclopentyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide
CID 16853182
2-(2-(hydroxymethyl)-5-methoxy-4-oxopyridin-1(4H)-yl)-N-isopropylacetamide
CID 16853211
2-(2-(hydroxymethyl)-5-methoxy-4-oxopyridin-1(4H)-yl)-N-(2-methoxyethyl)acetamide
CID 16853213
N-cyclopropyl-2-(2-(hydroxymethyl)-5-methoxy-4-oxopyridin-1(4H)-yl)acetamide
CID 53368412
N-(2-(cyclohex-1-en-1-yl)ethyl)-2-(2-(hydroxymethyl)-5-methoxy-4-oxopyridin-1(4H)-yl)acetamide
CID 53368692
2-(2-(hydroxymethyl)-5-methoxy-4-oxopyridin-1(4H)-yl)-N-isobutylacetamide
CID 56698847
2-(2-(hydroxymethyl)-5-methoxy-4-oxopyridin-1(4H)-yl)-N-isopentylacetamide
CID 56723694
2-(2-(hydroxymethyl)-5-methoxy-4-oxopyridin-1(4H)-yl)-N-(3-methoxypropyl)acetamide
CID 56763615
N-cycloheptyl-2-(5-methoxy-2-methyl-4-oxopyridin-1(4H)-yl)acetamide
CID 71707239
N-cycloheptyl-2-(5-methoxy-2-(morpholinomethyl)-4-oxopyridin-1(4H)-yl)acetamide
CID 71708974

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide?
The IUPAC name of N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide (CID 71707660) is N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide.
What is the SMILES notation for N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide?
The canonical SMILES for N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide is COc1cn(CC(=O)NC2CCCCCC2)c(CO)cc1=O.
What is the InChIKey of N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide?
The InChIKey is YCSWVDGXPLKUHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4/c1-22-15-9-18(13(11-19)8-14(15)20)10-16(21)17-12-6-4-2-3-5-7-12/h8-9,12,19H,2-7,10-11H2,1H3,(H,17,21).
What are the key properties of N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide?
N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide has a molecular weight of 308.38 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide is sourced from PubChem (CID 71707660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).