N-cyclooctyl-6-methyl-1H-indole-2-carboxamide

C18H24N2O — CID 118475592

IUPACN-cyclooctyl-6-methyl-1H-indole-2-carboxamide
SMILESCc1ccc2cc(C(=O)NC3CCCCCCC3)[nH]c2c1
InChIInChI=1S/C18H24N2O/c1-13-9-10-14-12-17(20-16(14)11-13)18(21)19-15-7-5-3-2-4-6-8-15/h9-12,15,20H,2-8H2,1H3,(H,19,21)
InChIKeyCAGJGUZCWMVWRO-UHFFFAOYSA-N
MW284.40 g/mol
LogP4.32
Rot. Bonds2

About N-cyclooctyl-6-methyl-1H-indole-2-carboxamide

N-cyclooctyl-6-methyl-1H-indole-2-carboxamide (PubChem CID 118475592) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-cyclooctyl-6-methyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-cyclooctyl-6-methyl-1H-indole-2-carboxamide
PubChem CID118475592
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-cyclooctyl-6-methyl-1H-indole-2-carboxamide
SMILESCc1ccc2cc(C(=O)NC3CCCCCCC3)[nH]c2c1
InChIInChI=1S/C18H24N2O/c1-13-9-10-14-12-17(20-16(14)11-13)18(21)19-15-7-5-3-2-4-6-8-15/h9-12,15,20H,2-8H2,1H3,(H,19,21)
InChIKeyCAGJGUZCWMVWRO-UHFFFAOYSA-N
XLogP4.32
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-6-methyl-1H-indole-2-carboxamide?
The IUPAC name of N-cyclooctyl-6-methyl-1H-indole-2-carboxamide (CID 118475592) is N-cyclooctyl-6-methyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-cyclooctyl-6-methyl-1H-indole-2-carboxamide?
The canonical SMILES for N-cyclooctyl-6-methyl-1H-indole-2-carboxamide is Cc1ccc2cc(C(=O)NC3CCCCCCC3)[nH]c2c1.
What is the InChIKey of N-cyclooctyl-6-methyl-1H-indole-2-carboxamide?
The InChIKey is CAGJGUZCWMVWRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-13-9-10-14-12-17(20-16(14)11-13)18(21)19-15-7-5-3-2-4-6-8-15/h9-12,15,20H,2-8H2,1H3,(H,19,21).
What are the key properties of N-cyclooctyl-6-methyl-1H-indole-2-carboxamide?
N-cyclooctyl-6-methyl-1H-indole-2-carboxamide has a molecular weight of 284.40 g/mol, XLogP of 4.32, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-6-methyl-1H-indole-2-carboxamide is sourced from PubChem (CID 118475592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).