N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide

C18H22N2O2 — CID 67865264

IUPACN-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide
SMILESCC(=O)N(C)C1c2ccccc2CC1N(C)Cc1ccco1
InChIInChI=1S/C18H22N2O2/c1-13(21)20(3)18-16-9-5-4-7-14(16)11-17(18)19(2)12-15-8-6-10-22-15/h4-10,17-18H,11-12H2,1-3H3
InChIKeyWPZJLLWJYUMTDB-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.86
Rot. Bonds4

About N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide

N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide (PubChem CID 67865264) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide.

Molecular Properties

Compound NameN-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide
PubChem CID67865264
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide
SMILESCC(=O)N(C)C1c2ccccc2CC1N(C)Cc1ccco1
InChIInChI=1S/C18H22N2O2/c1-13(21)20(3)18-16-9-5-4-7-14(16)11-17(18)19(2)12-15-8-6-10-22-15/h4-10,17-18H,11-12H2,1-3H3
InChIKeyWPZJLLWJYUMTDB-UHFFFAOYSA-N
XLogP2.86
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(furan-2-ylmethyl)-N-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)acetamide
CID 101142941
(1R)-N-(furan-2-ylmethyl)-N,2-dimethyl-3-oxo-1,4-dihydroisoquinoline-1-carboxamide
CID 95051160
N-(furan-2-ylmethyl)-N-methyl-2,3,4,5-tetrahydro-1H-2-benzazepin-5-amine
CID 103983188
1-(furan-2-yl)-N-(furan-2-ylmethyl)-N-methylmethanamine;hydrochloride
CID 3028206
3-(2,3-dihydro-1-benzofuran-2-ylmethyl)-1-(furan-2-ylmethyl)-1-methylurea
CID 53497871
1-(4-chlorophenyl)-3-[furan-2-ylmethyl(methyl)amino]propan-1-one
CID 62619027
4-[furan-2-ylmethyl(methyl)amino]-1-phenylbutan-1-one
CID 60695002
2-[furan-2-ylmethyl(methyl)amino]-1-(4-iodophenyl)ethanone
CID 62051012
3,4-dichloro-N-[(1R,2R)-2-[furan-2-ylmethyl(methyl)amino]cyclohexyl]benzamide
CID 22807733
3,4-dichloro-N-[2-[furan-2-ylmethyl(methyl)amino]cyclohexyl]benzamide
CID 23349703
2-benzyl-N-(furan-2-ylmethyl)-N-methyl-3-oxo-1,4-dihydroisoquinoline-1-carboxamide
CID 53147717
1-[furan-2-ylmethyl(methyl)amino]butan-2-one
CID 62038679

Frequently Asked Questions

What is the IUPAC name of N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide?
The IUPAC name of N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide (CID 67865264) is N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide.
What is the SMILES notation for N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide?
The canonical SMILES for N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide is CC(=O)N(C)C1c2ccccc2CC1N(C)Cc1ccco1.
What is the InChIKey of N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide?
The InChIKey is WPZJLLWJYUMTDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-13(21)20(3)18-16-9-5-4-7-14(16)11-17(18)19(2)12-15-8-6-10-22-15/h4-10,17-18H,11-12H2,1-3H3.
What are the key properties of N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide?
N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide has a molecular weight of 298.39 g/mol, XLogP of 2.86, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[furan-2-ylmethyl(methyl)amino]-2,3-dihydro-1H-inden-1-yl]-N-methylacetamide is sourced from PubChem (CID 67865264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).