N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide

C15H20N2O — CID 43421005

IUPACN-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide
SMILESCCN(CC(C)C)C(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C15H20N2O/c1-4-17(10-11(2)3)15(18)14-9-12-7-5-6-8-13(12)16-14/h5-9,11,16H,4,10H2,1-3H3
InChIKeyMWEOAGJYNHDLHI-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.29
Rot. Bonds4

About N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide

N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide (PubChem CID 43421005) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide
PubChem CID43421005
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide
SMILESCCN(CC(C)C)C(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C15H20N2O/c1-4-17(10-11(2)3)15(18)14-9-12-7-5-6-8-13(12)16-14/h5-9,11,16H,4,10H2,1-3H3
InChIKeyMWEOAGJYNHDLHI-UHFFFAOYSA-N
XLogP3.29
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-methylpropyl)-N-propan-2-yl-1H-indole-2-carboxamide
CID 55026359
N-(2-amino-2-oxoethyl)-N-ethyl-1H-indole-2-carboxamide
CID 103103798
N-ethyl-N-methyl-1H-indole-2-carboxamide
CID 43421002
N-ethyl-N-(thiophen-2-ylmethyl)-1H-indole-2-carboxamide
CID 33032265
N-methyl-N-propan-2-yl-1H-indole-2-carboxamide
CID 43420535
N-ethyl-N-[(3-fluorophenyl)methyl]-1H-indole-2-carboxamide
CID 51190000
N-(2,2-difluoroethyl)-N-methyl-1H-indole-2-carboxamide
CID 115611586
N-ethyl-N-phenyl-1H-indole-2-carboxamide
CID 43398536
2-[2-(dimethylamino)ethyl-(1H-indole-2-carbonyl)amino]acetic acid
CID 107424007
5-bromo-N,N-diethyl-1H-indole-2-carboxamide
CID 46555997
3-[3-ethoxypropyl(1H-indole-2-carbonyl)amino]-2-methylpropanoic acid
CID 119208402
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-ethyl-1H-indole-2-carboxamide
CID 25313237

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide?
The IUPAC name of N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide (CID 43421005) is N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide is CCN(CC(C)C)C(=O)c1cc2ccccc2[nH]1.
What is the InChIKey of N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide?
The InChIKey is MWEOAGJYNHDLHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-4-17(10-11(2)3)15(18)14-9-12-7-5-6-8-13(12)16-14/h5-9,11,16H,4,10H2,1-3H3.
What are the key properties of N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide?
N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide has a molecular weight of 244.34 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylpropyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 43421005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).