N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide

C15H18N2O2 — CID 43507845

IUPACN-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide
SMILESCCNC(C)c1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C15H18N2O2/c1-3-16-11(2)12-6-4-7-13(10-12)17-15(18)14-8-5-9-19-14/h4-11,16H,3H2,1-2H3,(H,17,18)
InChIKeyMYFAMOWWKLSODF-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.20
Rot. Bonds5

About N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide

N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide (PubChem CID 43507845) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide
PubChem CID43507845
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide
SMILESCCNC(C)c1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C15H18N2O2/c1-3-16-11(2)12-6-4-7-13(10-12)17-15(18)14-8-5-9-19-14/h4-11,16H,3H2,1-2H3,(H,17,18)
InChIKeyMYFAMOWWKLSODF-UHFFFAOYSA-N
XLogP3.20
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[1-(ethylamino)ethyl]phenyl]furan-3-carboxamide
CID 43507852
N-[3-[1-(ethylamino)ethyl]phenyl]-2-methylbutanamide
CID 43507836
N-[3-[1-(ethylamino)ethyl]phenyl]-6-methylpyridine-2-carboxamide
CID 43507835
N-[3-[1-(ethylamino)ethyl]phenyl]-1,3-dimethylpyrazole-4-carboxamide
CID 102801384
N-[3-[1-(ethylamino)ethyl]phenyl]-1H-pyrazole-4-carboxamide
CID 55182293
1-[3-[1-(ethylamino)ethyl]phenyl]-3-pentan-3-ylurea
CID 61340352
N-[3-[[2-(diethylamino)acetyl]amino]phenyl]furan-2-carboxamide
CID 54813683
N-[3-(2-hydroxypropylcarbamoyl)phenyl]furan-2-carboxamide
CID 78897732
1-phenylethyl 3-(furan-2-carbonylamino)benzoate
CID 78793343
2-methyl-N-[3-[1-(propylamino)ethyl]phenyl]furan-3-carboxamide
CID 43507889
N-[3-[[[ethylamino-(propan-2-ylamino)methylidene]amino]methyl]phenyl]furan-2-carboxamide
CID 111123845
2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]acetamide
CID 61339992

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide (CID 43507845) is N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide is CCNC(C)c1cccc(NC(=O)c2ccco2)c1.
What is the InChIKey of N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide?
The InChIKey is MYFAMOWWKLSODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-3-16-11(2)12-6-4-7-13(10-12)17-15(18)14-8-5-9-19-14/h4-11,16H,3H2,1-2H3,(H,17,18).
What are the key properties of N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide?
N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 3.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-(ethylamino)ethyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 43507845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).