N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide

C13H20N4O2 — CID 66266381

IUPACN-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)Nc1ccc(N(C)C)nc1
InChIInChI=1S/C13H20N4O2/c1-14-11-8-19-7-10(11)13(18)16-9-4-5-12(15-6-9)17(2)3/h4-6,10-11,14H,7-8H2,1-3H3,(H,16,18)
InChIKeyOREUMPPJVTUYHR-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.32
Rot. Bonds4

About N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide

N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide (PubChem CID 66266381) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide
PubChem CID66266381
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)Nc1ccc(N(C)C)nc1
InChIInChI=1S/C13H20N4O2/c1-14-11-8-19-7-10(11)13(18)16-9-4-5-12(15-6-9)17(2)3/h4-6,10-11,14H,7-8H2,1-3H3,(H,16,18)
InChIKeyOREUMPPJVTUYHR-UHFFFAOYSA-N
XLogP0.32
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide?
The IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide (CID 66266381) is N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide?
The canonical SMILES for N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide is CNC1COCC1C(=O)Nc1ccc(N(C)C)nc1.
What is the InChIKey of N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide?
The InChIKey is OREUMPPJVTUYHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-14-11-8-19-7-10(11)13(18)16-9-4-5-12(15-6-9)17(2)3/h4-6,10-11,14H,7-8H2,1-3H3,(H,16,18).
What are the key properties of N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide?
N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dimethylamino)-3-pyridinyl]-4-(methylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66266381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).