2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide

C11H17ClN2O2 — CID 106685261

IUPAC2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide
SMILESCCN(CC)CCNC(=O)c1ccoc1Cl
InChIInChI=1S/C11H17ClN2O2/c1-3-14(4-2)7-6-13-11(15)9-5-8-16-10(9)12/h5,8H,3-4,6-7H2,1-2H3,(H,13,15)
InChIKeyUIPQTKHKWIQFCJ-UHFFFAOYSA-N
MW244.72 g/mol
LogP2.00
Rot. Bonds6

About 2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide

2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide (PubChem CID 106685261) has the molecular formula C11H17ClN2O2 and a molecular weight of 244.72 g/mol. Its IUPAC name is 2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide
PubChem CID106685261
Molecular FormulaC11H17ClN2O2
Molecular Weight244.72 g/mol
Exact Mass244.10
IUPAC Name2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide
SMILESCCN(CC)CCNC(=O)c1ccoc1Cl
InChIInChI=1S/C11H17ClN2O2/c1-3-14(4-2)7-6-13-11(15)9-5-8-16-10(9)12/h5,8H,3-4,6-7H2,1-2H3,(H,13,15)
InChIKeyUIPQTKHKWIQFCJ-UHFFFAOYSA-N
XLogP2.00
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.72
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-propylfuran-3-carboxamide
CID 106685121
2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide
CID 106685683
2-chloro-N-[2-(diethylamino)ethyl]-5-methylbenzamide
CID 142825813
2-chloro-N-(3,3-dimethylbutyl)furan-3-carboxamide
CID 106687305
2-chloro-N-[2-[2-(dimethylamino)ethoxy]ethyl]furan-3-carboxamide
CID 106812685
2-chloro-N-[2-(cyclopropanecarbonylamino)ethyl]furan-3-carboxamide
CID 106687261
3-chloro-N-[2-(diethylamino)ethyl]-2-hydroxybenzamide
CID 21331733
2-chloro-N-(3-methylsulfinylpropyl)furan-3-carboxamide
CID 106687268
N-(5-amino-5-oxopentyl)-2-chlorofuran-3-carboxamide
CID 106812546
2-chloro-N-[2-(diethylamino)ethyl]-4-fluorobenzamide
CID 17144545
2-chloro-N-ethyl-N-methylfuran-3-carboxamide
CID 106685381
2-chloro-N-[2-(diethylamino)ethyl]quinoline-3-carboxamide
CID 2308981

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide?
The IUPAC name of 2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide (CID 106685261) is 2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide is CCN(CC)CCNC(=O)c1ccoc1Cl.
What is the InChIKey of 2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide?
The InChIKey is UIPQTKHKWIQFCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2O2/c1-3-14(4-2)7-6-13-11(15)9-5-8-16-10(9)12/h5,8H,3-4,6-7H2,1-2H3,(H,13,15).
What are the key properties of 2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide?
2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide has a molecular weight of 244.72 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide is sourced from PubChem (CID 106685261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).