8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide

C26H27N3O5 — CID 167843703

IUPAC8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide
SMILESCOc1cccc2c1OCC(C(=O)NC1CCCN(C(=O)c3ccc(-c4ccccn4)o3)C1)C2
InChIInChI=1S/C26H27N3O5/c1-32-22-9-4-6-17-14-18(16-33-24(17)22)25(30)28-19-7-5-13-29(15-19)26(31)23-11-10-21(34-23)20-8-2-3-12-27-20/h2-4,6,8-12,18-19H,5,7,13-16H2,1H3,(H,28,30)
InChIKeyAIDPYPQOJUIYQW-UHFFFAOYSA-N
MW461.52 g/mol
LogP3.32
Rot. Bonds5

About 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide

8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide (PubChem CID 167843703) has the molecular formula C26H27N3O5 and a molecular weight of 461.52 g/mol. Its IUPAC name is 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide.

Molecular Properties

Compound Name8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide
PubChem CID167843703
Molecular FormulaC26H27N3O5
Molecular Weight461.52 g/mol
Exact Mass461.20
IUPAC Name8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide
SMILESCOc1cccc2c1OCC(C(=O)NC1CCCN(C(=O)c3ccc(-c4ccccn4)o3)C1)C2
InChIInChI=1S/C26H27N3O5/c1-32-22-9-4-6-17-14-18(16-33-24(17)22)25(30)28-19-7-5-13-29(15-19)26(31)23-11-10-21(34-23)20-8-2-3-12-27-20/h2-4,6,8-12,18-19H,5,7,13-16H2,1H3,(H,28,30)
InChIKeyAIDPYPQOJUIYQW-UHFFFAOYSA-N
XLogP3.32
TPSA93.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.52
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide with MolForge

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Related Compounds

8-methoxy-N-[4-(4-methylpiperidine-1-carbonyl)cyclohexyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 169417243
(3S)-N-[1-(2-fluorophenyl)piperidin-4-yl]-8-methoxy-3,4-dihydro-2H-chromene-3-carboxamide
CID 97117554
[(3R)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]-[(3R)-3-pyrazol-1-ylpiperidin-1-yl]methanone
CID 95283159
(8-methoxy-3,4-dihydro-2H-chromen-3-yl)-(4-pyrimidin-2-yloxypiperidin-1-yl)methanone
CID 72871709
[(3R)-3-imidazol-1-ylpiperidin-1-yl]-[(3S)-8-methoxy-3,4-dihydro-2H-chromen-3-yl]methanone
CID 95309511
[2-[(8-methoxy-3,4-dihydro-2H-chromen-3-yl)methylamino]-4-pyridinyl]-piperidin-1-ylmethanone
CID 72881865
8-methoxy-N-[2-methyl-1-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)propyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 136858634
(3R)-8-methoxy-N-[(1R)-2-methyl-1-(6-oxo-2-pyridin-2-yl-1H-pyrimidin-4-yl)propyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 136891103
[2-[(8-methoxy-3,4-dihydro-2H-chromen-3-yl)methyl]-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 72890511
N-(8-methoxy-3,4-dihydro-2H-chromen-3-yl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 131927717
(8-methoxy-3,4-dihydro-2H-chromen-3-yl)-(1,4-oxazepan-4-yl)methanone
CID 70718890
(3R)-8-methoxy-3,4-dihydro-2H-chromene-3-carboxylic acid
CID 7023638

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide?
The IUPAC name of 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide (CID 167843703) is 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide.
What is the SMILES notation for 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide?
The canonical SMILES for 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide is COc1cccc2c1OCC(C(=O)NC1CCCN(C(=O)c3ccc(-c4ccccn4)o3)C1)C2.
What is the InChIKey of 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide?
The InChIKey is AIDPYPQOJUIYQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N3O5/c1-32-22-9-4-6-17-14-18(16-33-24(17)22)25(30)28-19-7-5-13-29(15-19)26(31)23-11-10-21(34-23)20-8-2-3-12-27-20/h2-4,6,8-12,18-19H,5,7,13-16H2,1H3,(H,28,30).
What are the key properties of 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide?
8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide has a molecular weight of 461.52 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-N-[1-(5-pyridin-2-ylfuran-2-carbonyl)piperidin-3-yl]-3,4-dihydro-2H-chromene-3-carboxamide is sourced from PubChem (CID 167843703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).