N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide

C16H23N3O2 — CID 102711691

IUPACN-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESCC(C)C(N)CCN(C)C(=O)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C16H23N3O2/c1-10(2)13(17)6-7-19(3)16(21)11-4-5-14-12(8-11)9-15(20)18-14/h4-5,8,10,13H,6-7,9,17H2,1-3H3,(H,18,20)
InChIKeyRZKQNWNZUMPGGB-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.63
Rot. Bonds5

About N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide

N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide (PubChem CID 102711691) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide.

Molecular Properties

Compound NameN-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide
PubChem CID102711691
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide
SMILESCC(C)C(N)CCN(C)C(=O)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C16H23N3O2/c1-10(2)13(17)6-7-19(3)16(21)11-4-5-14-12(8-11)9-15(20)18-14/h4-5,8,10,13H,6-7,9,17H2,1-3H3,(H,18,20)
InChIKeyRZKQNWNZUMPGGB-UHFFFAOYSA-N
XLogP1.63
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-3-methylbutyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 102711566
N-(3-hydroxybutyl)-N-methyl-2-oxo-1,3-dihydroindole-6-carboxamide
CID 102712770
N-(5-hydroxypentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide
CID 107203154
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-oxo-1,3-dihydroindole-5-carboxamide
CID 103190481
4-amino-N-(3-amino-4-methylpentyl)-N-methylbenzamide
CID 122080936
N-(3-amino-4-methylpentyl)-4-fluoro-N-methylbenzamide
CID 81484690
N-(3-aminobutyl)-2-oxo-1,3-dihydroindole-5-carboxamide
CID 102711492
N-(3-amino-4-methylpentyl)-4-[(2,5-dioxopyrrolidin-3-yl)methyl]-N-methylbenzamide;hydrochloride
CID 119659302
N-(3-amino-4-methylpentyl)-3,5-dihydroxy-N-methylbenzamide
CID 107705211
3-[ethyl-(2-oxo-1,3-dihydroindole-5-carbonyl)amino]-2-methylpropanoic acid
CID 102710709
N-(3-amino-4-methylpentyl)-1-cyclopentyl-N-methyl-2-oxo-3H-benzimidazole-5-carboxamide
CID 119660783
N-(3-amino-4-methylpentyl)-4-ethyl-N-methylbenzamide;hydrochloride
CID 119657274

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide?
The IUPAC name of N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide (CID 102711691) is N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide.
What is the SMILES notation for N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide?
The canonical SMILES for N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide is CC(C)C(N)CCN(C)C(=O)c1ccc2c(c1)CC(=O)N2.
What is the InChIKey of N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide?
The InChIKey is RZKQNWNZUMPGGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-10(2)13(17)6-7-19(3)16(21)11-4-5-14-12(8-11)9-15(20)18-14/h4-5,8,10,13H,6-7,9,17H2,1-3H3,(H,18,20).
What are the key properties of N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide?
N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylpentyl)-N-methyl-2-oxo-1,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 102711691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).