N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide

C12H17N3O2 — CID 115268574

IUPACN-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide
SMILESCCNc1ccc(NC(=O)C2CCCO2)cn1
InChIInChI=1S/C12H17N3O2/c1-2-13-11-6-5-9(8-14-11)15-12(16)10-4-3-7-17-10/h5-6,8,10H,2-4,7H2,1H3,(H,13,14)(H,15,16)
InChIKeyPZBGHWBIWGOWKK-UHFFFAOYSA-N
MW235.29 g/mol
LogP1.63
Rot. Bonds4

About N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide

N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide (PubChem CID 115268574) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide
PubChem CID115268574
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC NameN-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide
SMILESCCNc1ccc(NC(=O)C2CCCO2)cn1
InChIInChI=1S/C12H17N3O2/c1-2-13-11-6-5-9(8-14-11)15-12(16)10-4-3-7-17-10/h5-6,8,10H,2-4,7H2,1H3,(H,13,14)(H,15,16)
InChIKeyPZBGHWBIWGOWKK-UHFFFAOYSA-N
XLogP1.63
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(4-methoxyanilino)-3-pyridinyl]oxolane-2-carboxamide
CID 113019484
N-[5-[3-(dimethylamino)propylamino]-2-pyridinyl]oxolane-2-carboxamide
CID 113025707
N-[5-(cycloheptylamino)-2-pyridinyl]oxolane-2-carboxamide
CID 113030095
(2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide
CID 34666491
N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]oxolane-2-carboxamide
CID 113028252
N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]oxolane-2-carboxamide
CID 113013421
5-[[(2S)-oxolane-2-carbonyl]amino]pyridine-2-carboxylic acid
CID 104855894
N-[6-(4-cyanoanilino)-3-pyridinyl]oxolane-2-carboxamide
CID 113022851
N-[6-(2,6-difluoroanilino)-3-pyridinyl]oxolane-2-carboxamide
CID 113023110
N-[6-(2,3-dimethylanilino)-3-pyridinyl]oxolane-2-carboxamide
CID 113017251
N-[6-(4-phenoxyanilino)-3-pyridinyl]oxolane-2-carboxamide
CID 113021203
(2S)-N-(4-tert-butylphenyl)oxolane-2-carboxamide
CID 8779725

Frequently Asked Questions

What is the IUPAC name of N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide?
The IUPAC name of N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide (CID 115268574) is N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide?
The canonical SMILES for N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide is CCNc1ccc(NC(=O)C2CCCO2)cn1.
What is the InChIKey of N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide?
The InChIKey is PZBGHWBIWGOWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-2-13-11-6-5-9(8-14-11)15-12(16)10-4-3-7-17-10/h5-6,8,10H,2-4,7H2,1H3,(H,13,14)(H,15,16).
What are the key properties of N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide?
N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide is sourced from PubChem (CID 115268574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).