N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide

C16H16N2O2 — CID 99835392

IUPACN-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide
SMILESO=C(c1ccccn1)N(c1ccccc1)[C@H]1CCOC1
InChIInChI=1S/C16H16N2O2/c19-16(15-8-4-5-10-17-15)18(14-9-11-20-12-14)13-6-2-1-3-7-13/h1-8,10,14H,9,11-12H2/t14-/m0/s1
InChIKeyUJGIYPYUPKORJM-AWEZNQCLSA-N
MW268.32 g/mol
LogP2.52
Rot. Bonds3

About N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide

N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide (PubChem CID 99835392) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide
PubChem CID99835392
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide
SMILESO=C(c1ccccn1)N(c1ccccc1)[C@H]1CCOC1
InChIInChI=1S/C16H16N2O2/c19-16(15-8-4-5-10-17-15)18(14-9-11-20-12-14)13-6-2-1-3-7-13/h1-8,10,14H,9,11-12H2/t14-/m0/s1
InChIKeyUJGIYPYUPKORJM-AWEZNQCLSA-N
XLogP2.52
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide?
The IUPAC name of N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide (CID 99835392) is N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide.
What is the SMILES notation for N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide?
The canonical SMILES for N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide is O=C(c1ccccn1)N(c1ccccc1)[C@H]1CCOC1.
What is the InChIKey of N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide?
The InChIKey is UJGIYPYUPKORJM-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H16N2O2/c19-16(15-8-4-5-10-17-15)18(14-9-11-20-12-14)13-6-2-1-3-7-13/h1-8,10,14H,9,11-12H2/t14-/m0/s1.
What are the key properties of N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide?
N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide has a molecular weight of 268.32 g/mol, XLogP of 2.52, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-oxolan-3-yl]-N-phenylpyridine-2-carboxamide is sourced from PubChem (CID 99835392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).