(5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide

C12H16N2O3 — CID 167211610

IUPAC(5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
SMILESC[C@@H]1CCC(C(=O)Nc2ccnc(CO)c2)O1
InChIInChI=1S/C12H16N2O3/c1-8-2-3-11(17-8)12(16)14-9-4-5-13-10(6-9)7-15/h4-6,8,11,15H,2-3,7H2,1H3,(H,13,14,16)/t8-,11?/m1/s1
InChIKeyFPNCGAIODGXSCB-RZZZFEHKSA-N
MW236.27 g/mol
LogP1.08
Rot. Bonds3

About (5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide

(5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide (PubChem CID 167211610) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is (5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide.

Molecular Properties

Compound Name(5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
PubChem CID167211610
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Name(5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
SMILESC[C@@H]1CCC(C(=O)Nc2ccnc(CO)c2)O1
InChIInChI=1S/C12H16N2O3/c1-8-2-3-11(17-8)12(16)14-9-4-5-13-10(6-9)7-15/h4-6,8,11,15H,2-3,7H2,1H3,(H,13,14,16)/t8-,11?/m1/s1
InChIKeyFPNCGAIODGXSCB-RZZZFEHKSA-N
XLogP1.08
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-[2-(methylaminomethyl)-4-pyridinyl]oxolane-2-carboxamide
CID 166160576
(2R,5R)-N-[6-(hydroxymethyl)-3-pyridinyl]-5-methyloxolane-2-carboxamide
CID 166159129
N-[2-(2-fluoro-1-hydroxyethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
CID 167211525
N-[2-[(3,3-difluoropyrrolidin-1-yl)methyl]-4-pyridinyl]-5-methyloxolane-2-carboxamide
CID 166160325
(2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide
CID 166159062
N-[4-ethoxy-3-(hydroxymethyl)phenyl]-5-methyloxolane-2-carboxamide
CID 81329971
N-[2-[acetyl(methyl)amino]-4-pyridinyl]-5-methyloxolane-2-carboxamide
CID 166160944
N-[2-(methylamino)ethyl]-4-[(5-methyloxolane-2-carbonyl)amino]pyridine-2-carboxamide
CID 166159304
5-methyl-N-[2-[methyl-[2-(methylamino)acetyl]amino]-4-pyridinyl]oxolane-2-carboxamide
CID 166160891
N-[3-(methylamino)propyl]-4-[(5-methyloxolane-2-carbonyl)amino]pyridine-2-carboxamide
CID 177358074
N-[2-(3-hydroxy-2-oxopyrrolidin-1-yl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
CID 166161060
N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide
CID 81330062

Frequently Asked Questions

What is the IUPAC name of (5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide?
The IUPAC name of (5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide (CID 167211610) is (5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide.
What is the SMILES notation for (5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide?
The canonical SMILES for (5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide is C[C@@H]1CCC(C(=O)Nc2ccnc(CO)c2)O1.
What is the InChIKey of (5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide?
The InChIKey is FPNCGAIODGXSCB-RZZZFEHKSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-8-2-3-11(17-8)12(16)14-9-4-5-13-10(6-9)7-15/h4-6,8,11,15H,2-3,7H2,1H3,(H,13,14,16)/t8-,11?/m1/s1.
What are the key properties of (5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide?
(5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide has a molecular weight of 236.27 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide is sourced from PubChem (CID 167211610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).