N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide

C15H21N3O — CID 115305746

IUPACN-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide
SMILESCCC(N)(CC)CNC(=O)c1cccc2[nH]ccc12
InChIInChI=1S/C15H21N3O/c1-3-15(16,4-2)10-18-14(19)12-6-5-7-13-11(12)8-9-17-13/h5-9,17H,3-4,10,16H2,1-2H3,(H,18,19)
InChIKeyCMQDDFDSJLQDLF-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.42
Rot. Bonds5

About N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide

N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide (PubChem CID 115305746) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide
PubChem CID115305746
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC NameN-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide
SMILESCCC(N)(CC)CNC(=O)c1cccc2[nH]ccc12
InChIInChI=1S/C15H21N3O/c1-3-15(16,4-2)10-18-14(19)12-6-5-7-13-11(12)8-9-17-13/h5-9,17H,3-4,10,16H2,1-2H3,(H,18,19)
InChIKeyCMQDDFDSJLQDLF-UHFFFAOYSA-N
XLogP2.42
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-hydroxy-2,3-dimethylpentyl)-1H-indole-4-carboxamide
CID 111595853
N-(2-aminobutyl)-1H-indole-4-carboxamide
CID 63733452
1H-indole-4-carbohydrazide
CID 43316644
N-(2-hydroxypropyl)-1H-indole-4-carboxamide
CID 43501200
N-(3-methyl-2-propan-2-ylbutyl)-1H-indole-4-carboxamide
CID 102907617
methyl 2-hydroxy-3-(1H-indole-4-carbonylamino)propanoate
CID 103957814
N-(2,2-diethoxyethyl)-1H-indole-4-carboxamide
CID 79548414
N-(3-ethyl-2-hydroxypentyl)-1H-indole-4-carboxamide
CID 103723441
N-(2-amino-2-ethylbutyl)-3-bromo-2-methylbenzamide
CID 81483938
N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide
CID 103741634
N-[2-(2-methylpropylamino)-2-oxoethyl]-1H-indole-4-carboxamide
CID 115672235
N-(2-methyl-3-methylsulfanylpropyl)-1H-indole-4-carboxamide
CID 63960321

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide?
The IUPAC name of N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide (CID 115305746) is N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide.
What is the SMILES notation for N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide?
The canonical SMILES for N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide is CCC(N)(CC)CNC(=O)c1cccc2[nH]ccc12.
What is the InChIKey of N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide?
The InChIKey is CMQDDFDSJLQDLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-3-15(16,4-2)10-18-14(19)12-6-5-7-13-11(12)8-9-17-13/h5-9,17H,3-4,10,16H2,1-2H3,(H,18,19).
What are the key properties of N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide?
N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide has a molecular weight of 259.35 g/mol, XLogP of 2.42, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide is sourced from PubChem (CID 115305746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).