4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide

C12H18N2O3 — CID 5295327

IUPAC4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide
SMILESCCCOc1nc(C)cc(COC)c1C(N)=O
InChIInChI=1S/C12H18N2O3/c1-4-5-17-12-10(11(13)15)9(7-16-3)6-8(2)14-12/h6H,4-5,7H2,1-3H3,(H2,13,15)
InChIKeyKJNCIQVAKJWURW-UHFFFAOYSA-N
MW238.29 g/mol
LogP1.42
Rot. Bonds6

About 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide

4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide (PubChem CID 5295327) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide.

Molecular Properties

Compound Name4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide
PubChem CID5295327
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide
SMILESCCCOc1nc(C)cc(COC)c1C(N)=O
InChIInChI=1S/C12H18N2O3/c1-4-5-17-12-10(11(13)15)9(7-16-3)6-8(2)14-12/h6H,4-5,7H2,1-3H3,(H2,13,15)
InChIKeyKJNCIQVAKJWURW-UHFFFAOYSA-N
XLogP1.42
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide?
The IUPAC name of 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide (CID 5295327) is 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide.
What is the SMILES notation for 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide?
The canonical SMILES for 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide is CCCOc1nc(C)cc(COC)c1C(N)=O.
What is the InChIKey of 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide?
The InChIKey is KJNCIQVAKJWURW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-4-5-17-12-10(11(13)15)9(7-16-3)6-8(2)14-12/h6H,4-5,7H2,1-3H3,(H2,13,15).
What are the key properties of 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide?
4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 1.42, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-6-methyl-2-propoxypyridine-3-carboxamide is sourced from PubChem (CID 5295327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).