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

C25H26N2O4 — CID 4216659

IUPACN-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide
SMILESCOc1ccc(C(=O)N2CCc3oc(-c4cccc(NC(=O)C(C)C)c4)cc3C2)cc1
InChIInChI=1S/C25H26N2O4/c1-16(2)24(28)26-20-6-4-5-18(13-20)23-14-19-15-27(12-11-22(19)31-23)25(29)17-7-9-21(30-3)10-8-17/h4-10,13-14,16H,11-12,15H2,1-3H3,(H,26,28)
InChIKeyHCTAJHISCAUMDJ-UHFFFAOYSA-N
MW418.49 g/mol
LogP4.75
Rot. Bonds5

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

N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide (PubChem CID 4216659) has the molecular formula C25H26N2O4 and a molecular weight of 418.49 g/mol. Its IUPAC name is N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide
PubChem CID4216659
Molecular FormulaC25H26N2O4
Molecular Weight418.49 g/mol
Exact Mass418.19
IUPAC NameN-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide
SMILESCOc1ccc(C(=O)N2CCc3oc(-c4cccc(NC(=O)C(C)C)c4)cc3C2)cc1
InChIInChI=1S/C25H26N2O4/c1-16(2)24(28)26-20-6-4-5-18(13-20)23-14-19-15-27(12-11-22(19)31-23)25(29)17-7-9-21(30-3)10-8-17/h4-10,13-14,16H,11-12,15H2,1-3H3,(H,26,28)
InChIKeyHCTAJHISCAUMDJ-UHFFFAOYSA-N
XLogP4.75
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.49
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

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Related Compounds

N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-4-(trifluoromethyl)benzamide
CID 4302408
2-fluoro-N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]benzamide
CID 5073992
N-[3-[5-(3,4-dichlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-4-methoxybenzamide
CID 4588443
3-cyclopentyl-N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]propanamide
CID 4161020
N-[3-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]propanamide
CID 42785271
N-[4-[5-(4-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide
CID 3568013
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-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide
CID 42785279
N-[3-[5-(4-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2,2-dimethylpropanamide
CID 42783986
2-methoxy-N-[3-[5-(2-methylpropanoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide
CID 42784012
N-[3-[5-(1,3-benzodioxole-5-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2,2-diphenylacetamide
CID 3435362
N-[3-[5-(3-fluorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]acetamide
CID 42785230

Frequently Asked Questions

What is the IUPAC name of N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide?
The IUPAC name of N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide (CID 4216659) is N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide.
What is the SMILES notation for N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide?
The canonical SMILES for N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide is COc1ccc(C(=O)N2CCc3oc(-c4cccc(NC(=O)C(C)C)c4)cc3C2)cc1.
What is the InChIKey of N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide?
The InChIKey is HCTAJHISCAUMDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O4/c1-16(2)24(28)26-20-6-4-5-18(13-20)23-14-19-15-27(12-11-22(19)31-23)25(29)17-7-9-21(30-3)10-8-17/h4-10,13-14,16H,11-12,15H2,1-3H3,(H,26,28).
What are the key properties of N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide?
N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide has a molecular weight of 418.49 g/mol, XLogP of 4.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-methylpropanamide is sourced from PubChem (CID 4216659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).