2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide

C14H15N3O3 — CID 29180522

IUPAC2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
SMILESCOc1nc2c(cc1C(=O)NCc1ccon1)CCC2
InChIInChI=1S/C14H15N3O3/c1-19-14-11(7-9-3-2-4-12(9)16-14)13(18)15-8-10-5-6-20-17-10/h5-7H,2-4,8H2,1H3,(H,15,18)
InChIKeyZXBWTPGBMGIFGX-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.50
Rot. Bonds4

About 2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide

2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide (PubChem CID 29180522) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
PubChem CID29180522
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
SMILESCOc1nc2c(cc1C(=O)NCc1ccon1)CCC2
InChIInChI=1S/C14H15N3O3/c1-19-14-11(7-9-3-2-4-12(9)16-14)13(18)15-8-10-5-6-20-17-10/h5-7H,2-4,8H2,1H3,(H,15,18)
InChIKeyZXBWTPGBMGIFGX-UHFFFAOYSA-N
XLogP1.50
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[4-[(2-hydroxypropanoylamino)methyl]-2-pyridinyl]methyl]-2-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 162627516
2-methoxy-N-[(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 72840477
2-methoxy-N-[[5-(thiophen-2-ylmethyl)-1,2,4-oxadiazol-3-yl]methyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 72866403
N-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl]-2-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 72862412
N-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]-2-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 72847767
(3S)-3-(furan-2-yl)-3-[(2-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonyl)amino]propanoic acid
CID 97277113
2-hydroxy-4-methoxy-N-(1,2-oxazol-3-ylmethyl)benzamide
CID 79486904
N-[(2R)-3-(4-chlorophenoxy)-2-hydroxypropyl]-2-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 99936089
2-methoxy-N-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 72875071
N-(1,3-benzodioxol-5-ylmethyl)-2-methoxy-N-methyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide
CID 72935784
2,4-dihydroxy-N-(1,2-oxazol-3-ylmethyl)benzamide
CID 103721251
8a-ethyl-7-(2-methoxy-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonyl)-1,5,6,8-tetrahydro-[1,3]oxazolo[3,4-a]pyrazin-3-one
CID 146044342

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide?
The IUPAC name of 2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide (CID 29180522) is 2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide.
What is the SMILES notation for 2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide?
The canonical SMILES for 2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide is COc1nc2c(cc1C(=O)NCc1ccon1)CCC2.
What is the InChIKey of 2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide?
The InChIKey is ZXBWTPGBMGIFGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-19-14-11(7-9-3-2-4-12(9)16-14)13(18)15-8-10-5-6-20-17-10/h5-7H,2-4,8H2,1H3,(H,15,18).
What are the key properties of 2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide?
2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide has a molecular weight of 273.29 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1,2-oxazol-3-ylmethyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide is sourced from PubChem (CID 29180522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).