cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone

C16H19NO — CID 82279215

IUPACcyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone
SMILESCc1[nH]c2ccc(C(C)C)cc2c1C(=O)C1CC1
InChIInChI=1S/C16H19NO/c1-9(2)12-6-7-14-13(8-12)15(10(3)17-14)16(18)11-4-5-11/h6-9,11,17H,4-5H2,1-3H3
InChIKeyFMIFZYUFNOIWHC-UHFFFAOYSA-N
MW241.33 g/mol
LogP4.19
Rot. Bonds3

About cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone

cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone (PubChem CID 82279215) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone.

Molecular Properties

Compound Namecyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone
PubChem CID82279215
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Namecyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone
SMILESCc1[nH]c2ccc(C(C)C)cc2c1C(=O)C1CC1
InChIInChI=1S/C16H19NO/c1-9(2)12-6-7-14-13(8-12)15(10(3)17-14)16(18)11-4-5-11/h6-9,11,17H,4-5H2,1-3H3
InChIKeyFMIFZYUFNOIWHC-UHFFFAOYSA-N
XLogP4.19
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone?
The IUPAC name of cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone (CID 82279215) is cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone.
What is the SMILES notation for cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone?
The canonical SMILES for cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone is Cc1[nH]c2ccc(C(C)C)cc2c1C(=O)C1CC1.
What is the InChIKey of cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone?
The InChIKey is FMIFZYUFNOIWHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-9(2)12-6-7-14-13(8-12)15(10(3)17-14)16(18)11-4-5-11/h6-9,11,17H,4-5H2,1-3H3.
What are the key properties of cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone?
cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone has a molecular weight of 241.33 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(2-methyl-5-propan-2-yl-1H-indol-3-yl)methanone is sourced from PubChem (CID 82279215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).