N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide

C18H15Cl2N3O2 — CID 113031062

IUPACN-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NCCc2ccc(Cl)cc2Cl)cn1)c1ccco1
InChIInChI=1S/C18H15Cl2N3O2/c19-13-4-3-12(15(20)10-13)7-8-21-14-5-6-17(22-11-14)23-18(24)16-2-1-9-25-16/h1-6,9-11,21H,7-8H2,(H,22,23,24)
InChIKeyGMFLUDBRVHRLAG-UHFFFAOYSA-N
MW376.24 g/mol
LogP4.89
Rot. Bonds6

About N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide

N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide (PubChem CID 113031062) has the molecular formula C18H15Cl2N3O2 and a molecular weight of 376.24 g/mol. Its IUPAC name is N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide
PubChem CID113031062
Molecular FormulaC18H15Cl2N3O2
Molecular Weight376.24 g/mol
Exact Mass375.05
IUPAC NameN-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NCCc2ccc(Cl)cc2Cl)cn1)c1ccco1
InChIInChI=1S/C18H15Cl2N3O2/c19-13-4-3-12(15(20)10-13)7-8-21-14-5-6-17(22-11-14)23-18(24)16-2-1-9-25-16/h1-6,9-11,21H,7-8H2,(H,22,23,24)
InChIKeyGMFLUDBRVHRLAG-UHFFFAOYSA-N
XLogP4.89
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.24
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide
CID 113028255
N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 113031057
N-[5-(3-phenylpropylamino)-2-pyridinyl]furan-2-carboxamide
CID 113029807
N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]furan-2-carboxamide
CID 113012273
N-[6-[2-(2,4-dichlorophenyl)ethylamino]-3-pyridinyl]pyridine-3-carboxamide
CID 113015856
N-[5-[(2-methoxyphenyl)methylamino]-2-pyridinyl]furan-2-carboxamide
CID 113027322
N-[5-[2-chloro-5-(trifluoromethyl)anilino]-2-pyridinyl]furan-2-carboxamide
CID 113035477
N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]ethanesulfonamide
CID 113031073
2-(4-chlorophenyl)-N-[5-[2-(2-fluorophenyl)ethylamino]-2-pyridinyl]acetamide
CID 113028195
N-[5-(3,4-dimethylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113032100
N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide
CID 113027750
N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide
CID 113023557

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide?
The IUPAC name of N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide (CID 113031062) is N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide.
What is the SMILES notation for N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide?
The canonical SMILES for N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide is O=C(Nc1ccc(NCCc2ccc(Cl)cc2Cl)cn1)c1ccco1.
What is the InChIKey of N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide?
The InChIKey is GMFLUDBRVHRLAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2N3O2/c19-13-4-3-12(15(20)10-13)7-8-21-14-5-6-17(22-11-14)23-18(24)16-2-1-9-25-16/h1-6,9-11,21H,7-8H2,(H,22,23,24).
What are the key properties of N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide?
N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide has a molecular weight of 376.24 g/mol, XLogP of 4.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(2,4-dichlorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide is sourced from PubChem (CID 113031062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).