N,6-di(propan-2-yl)-3H-indole-2-carboxamide

C15H20N2O — CID 158958831

IUPACN,6-di(propan-2-yl)-3H-indole-2-carboxamide
SMILESCC(C)NC(=O)C1=Nc2cc(C(C)C)ccc2C1
InChIInChI=1S/C15H20N2O/c1-9(2)11-5-6-12-8-14(17-13(12)7-11)15(18)16-10(3)4/h5-7,9-10H,8H2,1-4H3,(H,16,18)
InChIKeyGQUQCIRNNLDDJQ-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.96
Rot. Bonds3

About N,6-di(propan-2-yl)-3H-indole-2-carboxamide

N,6-di(propan-2-yl)-3H-indole-2-carboxamide (PubChem CID 158958831) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N,6-di(propan-2-yl)-3H-indole-2-carboxamide.

Molecular Properties

Compound NameN,6-di(propan-2-yl)-3H-indole-2-carboxamide
PubChem CID158958831
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN,6-di(propan-2-yl)-3H-indole-2-carboxamide
SMILESCC(C)NC(=O)C1=Nc2cc(C(C)C)ccc2C1
InChIInChI=1S/C15H20N2O/c1-9(2)11-5-6-12-8-14(17-13(12)7-11)15(18)16-10(3)4/h5-7,9-10H,8H2,1-4H3,(H,16,18)
InChIKeyGQUQCIRNNLDDJQ-UHFFFAOYSA-N
XLogP2.96
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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(3-propan-2-ylphenyl) N-propan-2-ylcarbamate
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N-propan-2-yl-4-[(4-propan-2-ylphenyl)carbamoylamino]benzamide
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2-methyl-6-propan-2-yl-3H-indole;7-propan-2-yl-3H-indole
CID 177061562
2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide
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CID 19202796

Frequently Asked Questions

What is the IUPAC name of N,6-di(propan-2-yl)-3H-indole-2-carboxamide?
The IUPAC name of N,6-di(propan-2-yl)-3H-indole-2-carboxamide (CID 158958831) is N,6-di(propan-2-yl)-3H-indole-2-carboxamide.
What is the SMILES notation for N,6-di(propan-2-yl)-3H-indole-2-carboxamide?
The canonical SMILES for N,6-di(propan-2-yl)-3H-indole-2-carboxamide is CC(C)NC(=O)C1=Nc2cc(C(C)C)ccc2C1.
What is the InChIKey of N,6-di(propan-2-yl)-3H-indole-2-carboxamide?
The InChIKey is GQUQCIRNNLDDJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-9(2)11-5-6-12-8-14(17-13(12)7-11)15(18)16-10(3)4/h5-7,9-10H,8H2,1-4H3,(H,16,18).
What are the key properties of N,6-di(propan-2-yl)-3H-indole-2-carboxamide?
N,6-di(propan-2-yl)-3H-indole-2-carboxamide has a molecular weight of 244.34 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-di(propan-2-yl)-3H-indole-2-carboxamide is sourced from PubChem (CID 158958831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).