1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine

C15H16ClN3O — CID 106692423

IUPAC1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine
SMILESCNC(Cc1nn(C)c2ccccc12)c1ccoc1Cl
InChIInChI=1S/C15H16ClN3O/c1-17-12(11-7-8-20-15(11)16)9-13-10-5-3-4-6-14(10)19(2)18-13/h3-8,12,17H,9H2,1-2H3
InChIKeyRTIUKMFSEZZALH-UHFFFAOYSA-N
MW289.77 g/mol
LogP3.32
Rot. Bonds4

About 1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine

1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine (PubChem CID 106692423) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is 1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine.

Molecular Properties

Compound Name1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine
PubChem CID106692423
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC Name1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine
SMILESCNC(Cc1nn(C)c2ccccc12)c1ccoc1Cl
InChIInChI=1S/C15H16ClN3O/c1-17-12(11-7-8-20-15(11)16)9-13-10-5-3-4-6-14(10)19(2)18-13/h3-8,12,17H,9H2,1-2H3
InChIKeyRTIUKMFSEZZALH-UHFFFAOYSA-N
XLogP3.32
TPSA42.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-chlorofuran-3-yl)-2-(1-methylindazol-3-yl)ethanamine
CID 106692425
N-methyl-1-(1-methylimidazol-4-yl)-2-(1-methylindazol-3-yl)ethanamine
CID 107976079
N-methyl-2-(1-methylindazol-3-yl)-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
CID 105161454
1-(3-methylfuran-2-yl)-2-(1-methylindazol-3-yl)ethanol
CID 104800718
1-(2-chlorofuran-3-yl)-2-(1-methylindazol-3-yl)ethanone
CID 106691110
3-[3-chloro-2-(2-chlorophenyl)propyl]-1-methylindazole
CID 79437567
N,3,3-trimethyl-2-[(1-methylindazol-3-yl)methyl]butan-1-amine
CID 83139294
N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine
CID 105001190
N-methyl-1-(1-methylindazol-3-yl)-3-methylsulfonylbutan-2-amine
CID 105001238
1-(2-chloro-3-fluorophenyl)-2-(1-methylindazol-3-yl)ethanol
CID 115815135
1-(2-chlorofuran-3-yl)-2-(2,3-difluorophenyl)-N-methylethanamine
CID 106687910
N-methyl-1-(1-methylindazol-3-yl)methanamine;hydrochloride
CID 131083250

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine?
The IUPAC name of 1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine (CID 106692423) is 1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine.
What is the SMILES notation for 1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine?
The canonical SMILES for 1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine is CNC(Cc1nn(C)c2ccccc12)c1ccoc1Cl.
What is the InChIKey of 1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine?
The InChIKey is RTIUKMFSEZZALH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O/c1-17-12(11-7-8-20-15(11)16)9-13-10-5-3-4-6-14(10)19(2)18-13/h3-8,12,17H,9H2,1-2H3.
What are the key properties of 1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine?
1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine has a molecular weight of 289.77 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorofuran-3-yl)-N-methyl-2-(1-methylindazol-3-yl)ethanamine is sourced from PubChem (CID 106692423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).