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

C22H19FN2O3 — CID 42785230

IUPACN-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cc3c(o2)CCN(C(=O)c2cccc(F)c2)C3)c1
InChIInChI=1S/C22H19FN2O3/c1-14(26)24-19-7-3-4-15(11-19)21-12-17-13-25(9-8-20(17)28-21)22(27)16-5-2-6-18(23)10-16/h2-7,10-12H,8-9,13H2,1H3,(H,24,26)
InChIKeyYZGMUPPPLQKZAS-UHFFFAOYSA-N
MW378.40 g/mol
LogP4.24
Rot. Bonds3

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

N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide (PubChem CID 42785230) has the molecular formula C22H19FN2O3 and a molecular weight of 378.40 g/mol. Its IUPAC name is N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide
PubChem CID42785230
Molecular FormulaC22H19FN2O3
Molecular Weight378.40 g/mol
Exact Mass378.14
IUPAC NameN-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(-c2cc3c(o2)CCN(C(=O)c2cccc(F)c2)C3)c1
InChIInChI=1S/C22H19FN2O3/c1-14(26)24-19-7-3-4-15(11-19)21-12-17-13-25(9-8-20(17)28-21)22(27)16-5-2-6-18(23)10-16/h2-7,10-12H,8-9,13H2,1H3,(H,24,26)
InChIKeyYZGMUPPPLQKZAS-UHFFFAOYSA-N
XLogP4.24
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.40
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]benzamide
CID 42785234
ethyl 4-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]anilino]-4-oxobutanoate
CID 42785238
N-[3-[5-(4-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2,2-dimethylpropanamide
CID 42783986
3-fluoro-N-[4-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]benzamide
CID 42785137
N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]propanamide
CID 42785271
3-methyl-N-[3-[5-[3-(trifluoromethyl)benzoyl]-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]butanamide
CID 3544612
4-fluoro-N-[3-[5-(2-methylpropanoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]benzamide
CID 42784002
N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-3,3-dimethylbutanamide
CID 42785278
N-[3-[5-(3,4-dichlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-4-methoxybenzamide
CID 4588443
N-[3-[5-[3-(trifluoromethyl)benzoyl]-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]naphthalene-2-carboxamide
CID 5007619
N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide
CID 42785279
2-fluoro-N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]benzamide
CID 5073992

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide?
The IUPAC name of N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide (CID 42785230) is N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide.
What is the SMILES notation for N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide?
The canonical SMILES for N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide is CC(=O)Nc1cccc(-c2cc3c(o2)CCN(C(=O)c2cccc(F)c2)C3)c1.
What is the InChIKey of N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide?
The InChIKey is YZGMUPPPLQKZAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN2O3/c1-14(26)24-19-7-3-4-15(11-19)21-12-17-13-25(9-8-20(17)28-21)22(27)16-5-2-6-18(23)10-16/h2-7,10-12H,8-9,13H2,1H3,(H,24,26).
What are the key properties of N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide?
N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide has a molecular weight of 378.40 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide is sourced from PubChem (CID 42785230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).