2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide

C11H10ClNO3 — CID 106686601

IUPAC2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide
SMILESCN(Cc1ccoc1)C(=O)c1ccoc1Cl
InChIInChI=1S/C11H10ClNO3/c1-13(6-8-2-4-15-7-8)11(14)9-3-5-16-10(9)12/h2-5,7H,6H2,1H3
InChIKeyXLJJLKWEHJTAMS-UHFFFAOYSA-N
MW239.66 g/mol
LogP2.80
Rot. Bonds3

About 2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide

2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide (PubChem CID 106686601) has the molecular formula C11H10ClNO3 and a molecular weight of 239.66 g/mol. Its IUPAC name is 2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide
PubChem CID106686601
Molecular FormulaC11H10ClNO3
Molecular Weight239.66 g/mol
Exact Mass239.03
IUPAC Name2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide
SMILESCN(Cc1ccoc1)C(=O)c1ccoc1Cl
InChIInChI=1S/C11H10ClNO3/c1-13(6-8-2-4-15-7-8)11(14)9-3-5-16-10(9)12/h2-5,7H,6H2,1H3
InChIKeyXLJJLKWEHJTAMS-UHFFFAOYSA-N
XLogP2.80
TPSA46.59 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.66
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-methyl-N-[(4-methylphenyl)methyl]furan-3-carboxamide
CID 106685341
2-chloro-N-ethyl-N-methylfuran-3-carboxamide
CID 106685381
2-chloro-5-fluoro-N-(furan-3-ylmethyl)-N-methylpyridine-3-carboxamide
CID 114034200
5-chloro-N-(furan-3-ylmethyl)-N-methylpyrazine-2-carboxamide
CID 107252485
N-[(5-bromothiophen-3-yl)methyl]-2-chloro-N-methylfuran-3-carboxamide
CID 106685074
1-(2-chlorofuran-3-yl)-2-(furan-3-yl)ethanone
CID 106691241
N-(furan-3-ylmethyl)-2,5-dihydroxy-N-methylbenzamide
CID 107722501
N-(2-bromoethyl)-2-chloro-N-methylfuran-3-carboxamide
CID 106689914
2-chloro-N-methyl-N-[(3-nitrophenyl)methyl]furan-3-carboxamide
CID 106686292
N-(furan-3-ylmethyl)-N,4-dimethylbenzamide
CID 110868919
3-amino-N-(furan-3-ylmethyl)-N,2-dimethylbenzamide
CID 61421960
N-(furan-3-ylmethyl)-N-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 114039115

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide?
The IUPAC name of 2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide (CID 106686601) is 2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide?
The canonical SMILES for 2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide is CN(Cc1ccoc1)C(=O)c1ccoc1Cl.
What is the InChIKey of 2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide?
The InChIKey is XLJJLKWEHJTAMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNO3/c1-13(6-8-2-4-15-7-8)11(14)9-3-5-16-10(9)12/h2-5,7H,6H2,1H3.
What are the key properties of 2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide?
2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide has a molecular weight of 239.66 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(furan-3-ylmethyl)-N-methylfuran-3-carboxamide is sourced from PubChem (CID 106686601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).