4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole

C16H15NO — CID 116698575

IUPAC4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole
SMILESc1cc2c(c(-c3ccc4c(c3)COC4)c1)CCN2
InChIInChI=1S/C16H15NO/c1-2-14(15-6-7-17-16(15)3-1)11-4-5-12-9-18-10-13(12)8-11/h1-5,8,17H,6-7,9-10H2
InChIKeyGPCDOSMGLSVXRC-UHFFFAOYSA-N
MW237.30 g/mol
LogP3.35
Rot. Bonds1

About 4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole

4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole (PubChem CID 116698575) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is 4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole
PubChem CID116698575
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole
SMILESc1cc2c(c(-c3ccc4c(c3)COC4)c1)CCN2
InChIInChI=1S/C16H15NO/c1-2-14(15-6-7-17-16(15)3-1)11-4-5-12-9-18-10-13(12)8-11/h1-5,8,17H,6-7,9-10H2
InChIKeyGPCDOSMGLSVXRC-UHFFFAOYSA-N
XLogP3.35
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-naphthalen-2-yl-2,3-dihydro-1H-indole
CID 116698319
4-(3-fluoro-4-methylphenyl)-2,3-dihydro-1H-indole
CID 116698397
4-[4-fluoro-3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-indole
CID 107289624
4-(3-fluoro-4-methoxyphenyl)-2,3-dihydro-1H-indole
CID 116698337
4-(6-methyl-3-pyridinyl)-2,3-dihydro-1H-indole
CID 116698343
4-(3-chloro-5-fluorophenyl)-2,3-dihydro-1H-indole
CID 116698400
4-(4-cyclohexylphenyl)-2,3-dihydro-1H-indole
CID 116698555
3-(2,3-dihydro-1H-indol-4-yl)quinoline
CID 116698310
4-(1-methylpyrazol-4-yl)-2,3-dihydro-1H-indole
CID 116698328
3-(1,3-dihydro-2-benzofuran-5-yl)aniline
CID 63020601
4-(7-fluoro-1-benzofuran-2-yl)-2,3-dihydro-1H-indole
CID 114731967
4-[5-(2,3-dihydro-1H-indol-4-yl)thiophen-3-yl]morpholine
CID 141274171

Frequently Asked Questions

What is the IUPAC name of 4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole?
The IUPAC name of 4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole (CID 116698575) is 4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole.
What is the SMILES notation for 4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole?
The canonical SMILES for 4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole is c1cc2c(c(-c3ccc4c(c3)COC4)c1)CCN2.
What is the InChIKey of 4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole?
The InChIKey is GPCDOSMGLSVXRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c1-2-14(15-6-7-17-16(15)3-1)11-4-5-12-9-18-10-13(12)8-11/h1-5,8,17H,6-7,9-10H2.
What are the key properties of 4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole?
4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole has a molecular weight of 237.30 g/mol, XLogP of 3.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-dihydro-2-benzofuran-5-yl)-2,3-dihydro-1H-indole is sourced from PubChem (CID 116698575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).