N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide

C15H20N2O3 — CID 51979700

IUPACN-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide
SMILESCOCCOCCCNC(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C15H20N2O3/c1-19-9-10-20-8-4-7-16-15(18)14-11-12-5-2-3-6-13(12)17-14/h2-3,5-6,11,17H,4,7-10H2,1H3,(H,16,18)
InChIKeyXYHUGYYQQQDYRW-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.95
Rot. Bonds8

About N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide

N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide (PubChem CID 51979700) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide
PubChem CID51979700
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide
SMILESCOCCOCCCNC(=O)c1cc2ccccc2[nH]1
InChIInChI=1S/C15H20N2O3/c1-19-9-10-20-8-4-7-16-15(18)14-11-12-5-2-3-6-13(12)17-14/h2-3,5-6,11,17H,4,7-10H2,1H3,(H,16,18)
InChIKeyXYHUGYYQQQDYRW-UHFFFAOYSA-N
XLogP1.95
TPSA63.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-(2-methoxyethoxy)butyl]-1H-indole-2-carboxamide
CID 115599717
N-[3-(2,2,2-trifluoroethoxy)propyl]-1H-indole-2-carboxamide
CID 86930540
methyl 6-(1H-indole-2-carbonylamino)hexanoate
CID 43407298
N-(6-hydroxyhexyl)-1H-indole-2-carboxamide
CID 11492630
6-methoxy-N-(3-methoxypropyl)-1H-indole-2-carboxamide
CID 4905349
5-chloro-N-(3-methoxypropyl)-1H-indole-2-carboxamide
CID 4897321
N-[2-(2,2-difluoroethoxy)ethyl]-1H-indole-2-carboxamide
CID 103082568
N-hex-5-ynyl-1H-indole-2-carboxamide
CID 103758030
N-(3-pyrrol-1-ylpropyl)-1H-indole-2-carboxamide
CID 90500503
N-(cyanomethyl)-1H-indole-2-carboxamide
CID 61260784
N-[3-(4-fluorophenyl)sulfanylpropyl]-1H-indole-2-carboxamide
CID 27802085
N-[(E)-pent-3-enyl]-1H-indole-2-carboxamide
CID 115627991

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide?
The IUPAC name of N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide (CID 51979700) is N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide.
What is the SMILES notation for N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide?
The canonical SMILES for N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide is COCCOCCCNC(=O)c1cc2ccccc2[nH]1.
What is the InChIKey of N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide?
The InChIKey is XYHUGYYQQQDYRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-19-9-10-20-8-4-7-16-15(18)14-11-12-5-2-3-6-13(12)17-14/h2-3,5-6,11,17H,4,7-10H2,1H3,(H,16,18).
What are the key properties of N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide?
N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.95, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 51979700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).