3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide

C18H21N3O3 — CID 120965701

IUPAC3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide
SMILESCCc1cnccc1C(=O)N[C@H]1CCO[C@@H]1c1ccc(OC)nc1
InChIInChI=1S/C18H21N3O3/c1-3-12-10-19-8-6-14(12)18(22)21-15-7-9-24-17(15)13-4-5-16(23-2)20-11-13/h4-6,8,10-11,15,17H,3,7,9H2,1-2H3,(H,21,22)/t15-,17+/m0/s1
InChIKeyJVUWCRVMEJOTGE-DOTOQJQBSA-N
MW327.38 g/mol
LogP2.31
Rot. Bonds5

About 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide

3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide (PubChem CID 120965701) has the molecular formula C18H21N3O3 and a molecular weight of 327.38 g/mol. Its IUPAC name is 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide
PubChem CID120965701
Molecular FormulaC18H21N3O3
Molecular Weight327.38 g/mol
Exact Mass327.16
IUPAC Name3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide
SMILESCCc1cnccc1C(=O)N[C@H]1CCO[C@@H]1c1ccc(OC)nc1
InChIInChI=1S/C18H21N3O3/c1-3-12-10-19-8-6-14(12)18(22)21-15-7-9-24-17(15)13-4-5-16(23-2)20-11-13/h4-6,8,10-11,15,17H,3,7,9H2,1-2H3,(H,21,22)/t15-,17+/m0/s1
InChIKeyJVUWCRVMEJOTGE-DOTOQJQBSA-N
XLogP2.31
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide with MolForge

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Related Compounds

3-chloro-N-[(2R,3S)-2-(4-chlorophenyl)oxolan-3-yl]pyridine-4-carboxamide
CID 97256978
5-[3-(chloromethyl)oxolan-2-yl]-2-methoxypyridine
CID 114939001
2-[[(2S,3R)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]amino]-6,7-dihydrocyclopenta[b]pyridin-5-one
CID 167837041
1-[(2S,3R)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]-3-[4-(1-methyl-1,2,4-triazol-3-yl)phenyl]urea
CID 126825331
3-ethyl-N-[(2S,4S)-2-(3-methylimidazol-4-yl)oxan-4-yl]pyridine-4-carboxamide
CID 129339443
N-[(2R,3S)-2-(4-chlorophenyl)oxolan-3-yl]-2-methylpyridine-3-carboxamide
CID 97333744
(2R,3S)-N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-(6-methoxy-3-pyridinyl)oxolan-3-amine
CID 167794228
N-[[2-(6-methoxy-3-pyridinyl)oxan-3-yl]methyl]cyclopropanamine
CID 114938990
3-ethyl-N-methylpyridine-4-carboxamide
CID 130718112
3-ethyl-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]pyridine-4-carboxamide
CID 99842360
4-[[[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]amino]methyl]-1-methylpyrrole-2-carbonitrile
CID 120916528
N-[(2R,3S)-2-(1,5-dimethylpyrazol-4-yl)oxolan-3-yl]-3-fluoropyridine-4-carboxamide
CID 129003452

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide?
The IUPAC name of 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide (CID 120965701) is 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide.
What is the SMILES notation for 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide?
The canonical SMILES for 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide is CCc1cnccc1C(=O)N[C@H]1CCO[C@@H]1c1ccc(OC)nc1.
What is the InChIKey of 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide?
The InChIKey is JVUWCRVMEJOTGE-DOTOQJQBSA-N. The full InChI is InChI=1S/C18H21N3O3/c1-3-12-10-19-8-6-14(12)18(22)21-15-7-9-24-17(15)13-4-5-16(23-2)20-11-13/h4-6,8,10-11,15,17H,3,7,9H2,1-2H3,(H,21,22)/t15-,17+/m0/s1.
What are the key properties of 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide?
3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide has a molecular weight of 327.38 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[(2R,3S)-2-(6-methoxy-3-pyridinyl)oxolan-3-yl]pyridine-4-carboxamide is sourced from PubChem (CID 120965701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).