N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide

C16H20N2O — CID 79357254

IUPACN-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide
SMILESCC1(C)C(NC(=O)c2ccc3cc[nH]c3c2)C1(C)C
InChIInChI=1S/C16H20N2O/c1-15(2)14(16(15,3)4)18-13(19)11-6-5-10-7-8-17-12(10)9-11/h5-9,14,17H,1-4H3,(H,18,19)
InChIKeyYEUMTVOMARMMQJ-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.33
Rot. Bonds2

About N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide

N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide (PubChem CID 79357254) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide
PubChem CID79357254
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide
SMILESCC1(C)C(NC(=O)c2ccc3cc[nH]c3c2)C1(C)C
InChIInChI=1S/C16H20N2O/c1-15(2)14(16(15,3)4)18-13(19)11-6-5-10-7-8-17-12(10)9-11/h5-9,14,17H,1-4H3,(H,18,19)
InChIKeyYEUMTVOMARMMQJ-UHFFFAOYSA-N
XLogP3.33
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide?
The IUPAC name of N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide (CID 79357254) is N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide.
What is the SMILES notation for N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide?
The canonical SMILES for N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide is CC1(C)C(NC(=O)c2ccc3cc[nH]c3c2)C1(C)C.
What is the InChIKey of N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide?
The InChIKey is YEUMTVOMARMMQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-15(2)14(16(15,3)4)18-13(19)11-6-5-10-7-8-17-12(10)9-11/h5-9,14,17H,1-4H3,(H,18,19).
What are the key properties of N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide?
N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 3.33, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,3,3-tetramethylcyclopropyl)-1H-indole-6-carboxamide is sourced from PubChem (CID 79357254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).