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

C14H15ClN2O2 — CID 106685683

IUPAC2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide
SMILESCN(CCNC(=O)c1ccoc1Cl)c1ccccc1
InChIInChI=1S/C14H15ClN2O2/c1-17(11-5-3-2-4-6-11)9-8-16-14(18)12-7-10-19-13(12)15/h2-7,10H,8-9H2,1H3,(H,16,18)
InChIKeyDVJUQHKUPJFKEM-UHFFFAOYSA-N
MW278.74 g/mol
LogP2.80
Rot. Bonds5

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

2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide (PubChem CID 106685683) has the molecular formula C14H15ClN2O2 and a molecular weight of 278.74 g/mol. Its IUPAC name is 2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide
PubChem CID106685683
Molecular FormulaC14H15ClN2O2
Molecular Weight278.74 g/mol
Exact Mass278.08
IUPAC Name2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide
SMILESCN(CCNC(=O)c1ccoc1Cl)c1ccccc1
InChIInChI=1S/C14H15ClN2O2/c1-17(11-5-3-2-4-6-11)9-8-16-14(18)12-7-10-19-13(12)15/h2-7,10H,8-9H2,1H3,(H,16,18)
InChIKeyDVJUQHKUPJFKEM-UHFFFAOYSA-N
XLogP2.80
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.74
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-[2-(N-methylanilino)ethyl]pyridine-4-carboxamide
CID 114917579
2-chloro-N-[2-(diethylamino)ethyl]furan-3-carboxamide
CID 106685261
4-chloro-N-[2-(N-methylanilino)ethyl]pyridine-3-carboxamide
CID 81225507
1-N,4-N-bis[2-(N-methylanilino)ethyl]benzene-1,4-dicarboxamide
CID 35617422
2-chloro-N-propylfuran-3-carboxamide
CID 106685121
2-chloro-4-methyl-N-[2-(N-methylanilino)ethyl]benzamide
CID 99835968
3-amino-2-chloro-N-[2-(N-methylanilino)ethyl]benzamide
CID 115930279
2-amino-5-chloro-N-[2-(N-methylanilino)ethyl]benzamide
CID 61111968
2-chloro-4-fluoro-N-[2-(N-methylanilino)ethyl]benzamide
CID 25395334
2-chloro-5-fluoro-N-[2-(N-methylanilino)ethyl]pyridine-3-carboxamide
CID 103939963
2,4,5-trimethyl-N-[2-(N-methylanilino)ethyl]benzamide
CID 100710814
2-bromo-3-methyl-N-[2-(N-methylanilino)ethyl]benzamide
CID 103852994

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide?
The IUPAC name of 2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide (CID 106685683) is 2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide is CN(CCNC(=O)c1ccoc1Cl)c1ccccc1.
What is the InChIKey of 2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide?
The InChIKey is DVJUQHKUPJFKEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2/c1-17(11-5-3-2-4-6-11)9-8-16-14(18)12-7-10-19-13(12)15/h2-7,10H,8-9H2,1H3,(H,16,18).
What are the key properties of 2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide?
2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide has a molecular weight of 278.74 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(N-methylanilino)ethyl]furan-3-carboxamide is sourced from PubChem (CID 106685683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).