N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide

C17H24N2O3 — CID 133267139

IUPACN-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)N[C@@H]1CCOC[C@@H]1C1CCOCC1
InChIInChI=1S/C17H24N2O3/c20-17(10-13-2-1-6-18-11-13)19-16-5-9-22-12-15(16)14-3-7-21-8-4-14/h1-2,6,11,14-16H,3-5,7-10,12H2,(H,19,20)/t15-,16-/m1/s1
InChIKeyPHEFFINQLFXSAS-HZPDHXFCSA-N
MW304.39 g/mol
LogP1.57
Rot. Bonds4

About N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide

N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide (PubChem CID 133267139) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide
PubChem CID133267139
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide
SMILESO=C(Cc1cccnc1)N[C@@H]1CCOC[C@@H]1C1CCOCC1
InChIInChI=1S/C17H24N2O3/c20-17(10-13-2-1-6-18-11-13)19-16-5-9-22-12-15(16)14-3-7-21-8-4-14/h1-2,6,11,14-16H,3-5,7-10,12H2,(H,19,20)/t15-,16-/m1/s1
InChIKeyPHEFFINQLFXSAS-HZPDHXFCSA-N
XLogP1.57
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-chlorophenyl)-N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]acetamide
CID 133265749
N-[(3R,3aR,6R,6aR)-6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]-3-pyridin-3-ylpropanamide
CID 154822153
N-(1,9-dioxaspiro[5.5]undecan-4-yl)-2-pyridin-3-ylacetamide
CID 77087174
N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-4-(1H-pyrazol-4-yl)butanamide
CID 133267954
2-[(2-pyridin-3-ylacetyl)amino]cyclopentane-1-carboxylic acid
CID 64813919
7-methyl-N-[(3R,4R)-3-[(2-pyridin-3-ylacetyl)amino]oxan-4-yl]-1-benzofuran-3-carboxamide
CID 138046587
N-(2-aminocycloheptyl)-2-pyridin-3-ylacetamide
CID 55169173
1-(oxolan-3-yl)-3-pyridin-3-ylpropan-1-one
CID 105099703
2-(3-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(3S,4S)-3-(oxan-4-yl)oxan-4-yl]acetamide
CID 91792273
2-pyridin-3-yl-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]acetamide
CID 91774888
N-[(3S,4R)-3-phenylmethoxyoxan-4-yl]-2-pyrazin-2-ylacetamide
CID 91792659
4-[(2-pyridin-3-ylacetyl)amino]cyclohexane-1-carboxylic acid
CID 62689674

Frequently Asked Questions

What is the IUPAC name of N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide (CID 133267139) is N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide is O=C(Cc1cccnc1)N[C@@H]1CCOC[C@@H]1C1CCOCC1.
What is the InChIKey of N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide?
The InChIKey is PHEFFINQLFXSAS-HZPDHXFCSA-N. The full InChI is InChI=1S/C17H24N2O3/c20-17(10-13-2-1-6-18-11-13)19-16-5-9-22-12-15(16)14-3-7-21-8-4-14/h1-2,6,11,14-16H,3-5,7-10,12H2,(H,19,20)/t15-,16-/m1/s1.
What are the key properties of N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide?
N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide has a molecular weight of 304.39 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R,4R)-3-(oxan-4-yl)oxan-4-yl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 133267139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).