2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide

C21H21ClN2O2 — CID 15428624

IUPAC2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide
SMILESCN(C)C1CCc2oc3ccc(NC(=O)c4ccccc4Cl)cc3c2C1
InChIInChI=1S/C21H21ClN2O2/c1-24(2)14-8-10-20-17(12-14)16-11-13(7-9-19(16)26-20)23-21(25)15-5-3-4-6-18(15)22/h3-7,9,11,14H,8,10,12H2,1-2H3,(H,23,25)
InChIKeyLQZZKUZMPGQVSG-UHFFFAOYSA-N
MW368.86 g/mol
LogP4.76
Rot. Bonds3

About 2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide

2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide (PubChem CID 15428624) has the molecular formula C21H21ClN2O2 and a molecular weight of 368.86 g/mol. Its IUPAC name is 2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide
PubChem CID15428624
Molecular FormulaC21H21ClN2O2
Molecular Weight368.86 g/mol
Exact Mass368.13
IUPAC Name2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide
SMILESCN(C)C1CCc2oc3ccc(NC(=O)c4ccccc4Cl)cc3c2C1
InChIInChI=1S/C21H21ClN2O2/c1-24(2)14-8-10-20-17(12-14)16-11-13(7-9-19(16)26-20)23-21(25)15-5-3-4-6-18(15)22/h3-7,9,11,14H,8,10,12H2,1-2H3,(H,23,25)
InChIKeyLQZZKUZMPGQVSG-UHFFFAOYSA-N
XLogP4.76
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.86
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-1-benzofuran-3-carboxamide
CID 21221600
N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2,4-difluorobenzamide
CID 15428625
N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-phenylacetamide
CID 21221684
N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]pyrazine-2-carboxamide
CID 21221588
N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]prop-2-enamide
CID 21221648
2,2-dichloroacetic acid;N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]isoquinoline-1-carboxamide
CID 21221668
N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]-2-(3-methoxythiophen-2-yl)acetamide
CID 21221743
ethyl 8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-carboxylate
CID 21221595
2-chloro-N-[2-(2-fluorophenyl)-4-oxochromen-6-yl]benzamide
CID 18568768
N-[6-(dimethylamino)-6,7,8,9-tetrahydro-5H-carbazol-3-yl]cyclopropanecarboxamide
CID 22611246
N-(3-acetyl-4-chlorophenyl)-2-chlorobenzamide
CID 22888926
2-chloro-N-(2-oxochromen-6-yl)benzamide
CID 965741

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide?
The IUPAC name of 2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide (CID 15428624) is 2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide.
What is the SMILES notation for 2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide?
The canonical SMILES for 2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide is CN(C)C1CCc2oc3ccc(NC(=O)c4ccccc4Cl)cc3c2C1.
What is the InChIKey of 2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide?
The InChIKey is LQZZKUZMPGQVSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21ClN2O2/c1-24(2)14-8-10-20-17(12-14)16-11-13(7-9-19(16)26-20)23-21(25)15-5-3-4-6-18(15)22/h3-7,9,11,14H,8,10,12H2,1-2H3,(H,23,25).
What are the key properties of 2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide?
2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide has a molecular weight of 368.86 g/mol, XLogP of 4.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[8-(dimethylamino)-6,7,8,9-tetrahydrodibenzofuran-2-yl]benzamide is sourced from PubChem (CID 15428624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).