N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide

C15H20N2O3 — CID 110895331

IUPACN-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide
SMILESCCC(=O)N1CCc2cc(C(=O)N(C)CCO)ccc21
InChIInChI=1S/C15H20N2O3/c1-3-14(19)17-7-6-11-10-12(4-5-13(11)17)15(20)16(2)8-9-18/h4-5,10,18H,3,6-9H2,1-2H3
InChIKeyRRUDCUOIKCJPHA-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.05
Rot. Bonds4

About N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide

N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide (PubChem CID 110895331) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide
PubChem CID110895331
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide
SMILESCCC(=O)N1CCc2cc(C(=O)N(C)CCO)ccc21
InChIInChI=1S/C15H20N2O3/c1-3-14(19)17-7-6-11-10-12(4-5-13(11)17)15(20)16(2)8-9-18/h4-5,10,18H,3,6-9H2,1-2H3
InChIKeyRRUDCUOIKCJPHA-UHFFFAOYSA-N
XLogP1.05
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxyethyl)-N,1-dimethyl-2,3-dihydroindole-5-carboxamide
CID 110485469
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 55787446
N-[3-(N-methylanilino)propyl]-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 55787673
1-[methyl(propyl)carbamoyl]-2,3-dihydroindole-5-carboxylic acid
CID 61195869
N-(2-hydroxyethyl)-N-methyl-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 60740767
N-methyl-N-[1-(3-nitrophenyl)ethyl]-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 55789656
N-cyclopropyl-N-[(4-fluorophenyl)methyl]-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 167782754
N-[[4-(diethylaminomethyl)phenyl]methyl]-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 46490523
1-butanoyl-2,3-dihydroindole-5-carboxylic acid
CID 43142326
N-(4-hydroxy-2-methylpentyl)-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 111447607
N-[(1-hydroxycyclohexyl)methyl]-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 111446079
N-[4-[ethyl(propan-2-yl)amino]phenyl]-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 55786918

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide (CID 110895331) is N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide is CCC(=O)N1CCc2cc(C(=O)N(C)CCO)ccc21.
What is the InChIKey of N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide?
The InChIKey is RRUDCUOIKCJPHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-3-14(19)17-7-6-11-10-12(4-5-13(11)17)15(20)16(2)8-9-18/h4-5,10,18H,3,6-9H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide?
N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methyl-1-propanoyl-2,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 110895331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).