N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide

C16H24N2O4 — CID 164631992

IUPACN-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide
SMILESCO[C@@]1(CNC(=O)c2ccc(OC(C)(C)C)cn2)CCOC1
InChIInChI=1S/C16H24N2O4/c1-15(2,3)22-12-5-6-13(17-9-12)14(19)18-10-16(20-4)7-8-21-11-16/h5-6,9H,7-8,10-11H2,1-4H3,(H,18,19)/t16-/m1/s1
InChIKeyRFCRUXYKRKSPIX-MRXNPFEDSA-N
MW308.38 g/mol
LogP1.79
Rot. Bonds5

About N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide

N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide (PubChem CID 164631992) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide
PubChem CID164631992
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC NameN-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide
SMILESCO[C@@]1(CNC(=O)c2ccc(OC(C)(C)C)cn2)CCOC1
InChIInChI=1S/C16H24N2O4/c1-15(2,3)22-12-5-6-13(17-9-12)14(19)18-10-16(20-4)7-8-21-11-16/h5-6,9H,7-8,10-11H2,1-4H3,(H,18,19)/t16-/m1/s1
InChIKeyRFCRUXYKRKSPIX-MRXNPFEDSA-N
XLogP1.79
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide?
The IUPAC name of N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide (CID 164631992) is N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide.
What is the SMILES notation for N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide?
The canonical SMILES for N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide is CO[C@@]1(CNC(=O)c2ccc(OC(C)(C)C)cn2)CCOC1.
What is the InChIKey of N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide?
The InChIKey is RFCRUXYKRKSPIX-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H24N2O4/c1-15(2,3)22-12-5-6-13(17-9-12)14(19)18-10-16(20-4)7-8-21-11-16/h5-6,9H,7-8,10-11H2,1-4H3,(H,18,19)/t16-/m1/s1.
What are the key properties of N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide?
N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(3R)-3-methoxyoxolan-3-yl]methyl]-5-[(2-methylpropan-2-yl)oxy]pyridine-2-carboxamide is sourced from PubChem (CID 164631992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).