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

C25H23ClN2O3 — CID 4522921

IUPACN-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide
SMILESO=C(Nc1ccc(-c2cc3c(o2)CCN(C(=O)c2ccccc2Cl)C3)cc1)C1CCC1
InChIInChI=1S/C25H23ClN2O3/c26-21-7-2-1-6-20(21)25(30)28-13-12-22-18(15-28)14-23(31-22)16-8-10-19(11-9-16)27-24(29)17-4-3-5-17/h1-2,6-11,14,17H,3-5,12-13,15H2,(H,27,29)
InChIKeyAXICTBCCYISFJC-UHFFFAOYSA-N
MW434.92 g/mol
LogP5.54
Rot. Bonds4

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

N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide (PubChem CID 4522921) has the molecular formula C25H23ClN2O3 and a molecular weight of 434.92 g/mol. Its IUPAC name is N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide
PubChem CID4522921
Molecular FormulaC25H23ClN2O3
Molecular Weight434.92 g/mol
Exact Mass434.14
IUPAC NameN-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide
SMILESO=C(Nc1ccc(-c2cc3c(o2)CCN(C(=O)c2ccccc2Cl)C3)cc1)C1CCC1
InChIInChI=1S/C25H23ClN2O3/c26-21-7-2-1-6-20(21)25(30)28-13-12-22-18(15-28)14-23(31-22)16-8-10-19(11-9-16)27-24(29)17-4-3-5-17/h1-2,6-11,14,17H,3-5,12-13,15H2,(H,27,29)
InChIKeyAXICTBCCYISFJC-UHFFFAOYSA-N
XLogP5.54
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.92
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-4-fluorobenzamide
CID 42784995
N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-3,5-dimethoxybenzamide
CID 5055434
N-[4-[5-(3-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclohexanecarboxamide
CID 42785134
N-[3-[5-(cyclohexanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide
CID 4195188
N-[4-[5-(1,3-benzodioxole-5-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclopropanecarboxamide
CID 3576803
2,4-dichloro-N-[4-[5-(naphthalene-1-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]benzamide
CID 5052270
3-chloro-N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2,2-dimethylpropanamide
CID 42785120
N-[4-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide
CID 42785121
N-[3-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2-phenoxyacetamide
CID 3673935
3,5-dimethoxy-N-[4-[5-(naphthalene-1-carbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]benzamide
CID 4302474
2-fluoro-N-[4-[5-(4-methoxybenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]benzamide
CID 42784409
3-chloro-N-[3-[5-(cyclobutanecarbonyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]-2,2-dimethylpropanamide
CID 42785260

Frequently Asked Questions

What is the IUPAC name of N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide?
The IUPAC name of N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide (CID 4522921) is N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide.
What is the SMILES notation for N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide?
The canonical SMILES for N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide is O=C(Nc1ccc(-c2cc3c(o2)CCN(C(=O)c2ccccc2Cl)C3)cc1)C1CCC1.
What is the InChIKey of N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide?
The InChIKey is AXICTBCCYISFJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23ClN2O3/c26-21-7-2-1-6-20(21)25(30)28-13-12-22-18(15-28)14-23(31-22)16-8-10-19(11-9-16)27-24(29)17-4-3-5-17/h1-2,6-11,14,17H,3-5,12-13,15H2,(H,27,29).
What are the key properties of N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide?
N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide has a molecular weight of 434.92 g/mol, XLogP of 5.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[5-(2-chlorobenzoyl)-6,7-dihydro-4H-furo[3,2-c]pyridin-2-yl]phenyl]cyclobutanecarboxamide is sourced from PubChem (CID 4522921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).