N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide

C27H24N2O5 — CID 42784454

IUPACN-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide
SMILESO=C(COCc1ccccc1)Nc1ccc(-c2cc3c(o2)CCN(C(=O)c2ccco2)C3)cc1
InChIInChI=1S/C27H24N2O5/c30-26(18-32-17-19-5-2-1-3-6-19)28-22-10-8-20(9-11-22)25-15-21-16-29(13-12-23(21)34-25)27(31)24-7-4-14-33-24/h1-11,14-15H,12-13,16-18H2,(H,28,30)
InChIKeyMUNOEGWOKPDPQD-UHFFFAOYSA-N
MW456.50 g/mol
LogP4.89
Rot. Bonds7

About N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide

N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide (PubChem CID 42784454) has the molecular formula C27H24N2O5 and a molecular weight of 456.50 g/mol. Its IUPAC name is N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide.

Molecular Properties

Compound NameN-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide
PubChem CID42784454
Molecular FormulaC27H24N2O5
Molecular Weight456.50 g/mol
Exact Mass456.17
IUPAC NameN-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide
SMILESO=C(COCc1ccccc1)Nc1ccc(-c2cc3c(o2)CCN(C(=O)c2ccco2)C3)cc1
InChIInChI=1S/C27H24N2O5/c30-26(18-32-17-19-5-2-1-3-6-19)28-22-10-8-20(9-11-22)25-15-21-16-29(13-12-23(21)34-25)27(31)24-7-4-14-33-24/h1-11,14-15H,12-13,16-18H2,(H,28,30)
InChIKeyMUNOEGWOKPDPQD-UHFFFAOYSA-N
XLogP4.89
TPSA84.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.50
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide with MolForge

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Related Compounds

N-[4-[5-(2-methylpropanoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide
CID 42785019
N-[4-(5-acetyl-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl)phenyl]-3-phenylpropanamide
CID 42785029
N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide
CID 42785121
2-methoxy-N-[4-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide
CID 42785142
2-phenoxy-N-[4-[5-[3-(trifluoromethyl)benzoyl]-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide
CID 4059589
N-[4-[(2-phenylmethoxyacetyl)amino]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 68753684
N-[2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-methoxyacetamide
CID 16943271
3-cyclopentyl-N-[4-[5-(3-phenylpropanoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]propanamide
CID 42785069
N-[4-[5-(thiophene-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]propanamide
CID 4104318
N-[2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2-(4-methylphenoxy)acetamide
CID 16943302
2-(2-chlorophenoxy)-N-[2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]acetamide
CID 16943317
2-chloro-1-(2-phenyl-6,7-dihydro-4H-furo[3,2-c]pyridin-5-yl)ethanone
CID 166408897

Frequently Asked Questions

What is the IUPAC name of N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide?
The IUPAC name of N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide (CID 42784454) is N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide.
What is the SMILES notation for N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide?
The canonical SMILES for N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide is O=C(COCc1ccccc1)Nc1ccc(-c2cc3c(o2)CCN(C(=O)c2ccco2)C3)cc1.
What is the InChIKey of N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide?
The InChIKey is MUNOEGWOKPDPQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N2O5/c30-26(18-32-17-19-5-2-1-3-6-19)28-22-10-8-20(9-11-22)25-15-21-16-29(13-12-23(21)34-25)27(31)24-7-4-14-33-24/h1-11,14-15H,12-13,16-18H2,(H,28,30).
What are the key properties of N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide?
N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide has a molecular weight of 456.50 g/mol, XLogP of 4.89, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-(furan-2-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenylmethoxyacetamide is sourced from PubChem (CID 42784454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).