N-(6-hydroxyhexyl)-1H-indole-2-carboxamide

C15H20N2O2 — CID 11492630

IUPACN-(6-hydroxyhexyl)-1H-indole-2-carboxamide
SMILESO=C(NCCCCCCO)c1cc2ccccc2[nH]1
InChIInChI=1S/C15H20N2O2/c18-10-6-2-1-5-9-16-15(19)14-11-12-7-3-4-8-13(12)17-14/h3-4,7-8,11,17-18H,1-2,5-6,9-10H2,(H,16,19)
InChIKeyGVXWRMNUFGFSQR-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.45
Rot. Bonds7

About N-(6-hydroxyhexyl)-1H-indole-2-carboxamide

N-(6-hydroxyhexyl)-1H-indole-2-carboxamide (PubChem CID 11492630) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(6-hydroxyhexyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(6-hydroxyhexyl)-1H-indole-2-carboxamide
PubChem CID11492630
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-(6-hydroxyhexyl)-1H-indole-2-carboxamide
SMILESO=C(NCCCCCCO)c1cc2ccccc2[nH]1
InChIInChI=1S/C15H20N2O2/c18-10-6-2-1-5-9-16-15(19)14-11-12-7-3-4-8-13(12)17-14/h3-4,7-8,11,17-18H,1-2,5-6,9-10H2,(H,16,19)
InChIKeyGVXWRMNUFGFSQR-UHFFFAOYSA-N
XLogP2.45
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-hex-5-ynyl-1H-indole-2-carboxamide
CID 103758030
N-(6-hydroxyhexyl)-1-oxo-2H-isoquinoline-3-carboxamide
CID 103919131
methyl 6-(1H-indole-2-carbonylamino)hexanoate
CID 43407298
N-[4-(2-methoxyethoxy)butyl]-1H-indole-2-carboxamide
CID 115599717
N-(3-pyrrol-1-ylpropyl)-1H-indole-2-carboxamide
CID 90500503
N-[3-(2-methoxyethoxy)propyl]-1H-indole-2-carboxamide
CID 51979700
7-amino-N-(4-hydroxybutyl)-1H-indole-2-carboxamide
CID 106840111
N-[2-(prop-2-enoylamino)ethyl]-1H-indole-2-carboxamide
CID 146087723
6-bromo-N-(3-hydroxypropyl)-1H-indole-2-carboxamide
CID 78854248
N-[3-(2,2,2-trifluoroethoxy)propyl]-1H-indole-2-carboxamide
CID 86930540
N-[3-(4-fluorophenyl)sulfanylpropyl]-1H-indole-2-carboxamide
CID 27802085
N-[2-[(4-chlorobenzoyl)amino]ethyl]-1H-indole-2-carboxamide
CID 34999950

Frequently Asked Questions

What is the IUPAC name of N-(6-hydroxyhexyl)-1H-indole-2-carboxamide?
The IUPAC name of N-(6-hydroxyhexyl)-1H-indole-2-carboxamide (CID 11492630) is N-(6-hydroxyhexyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(6-hydroxyhexyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(6-hydroxyhexyl)-1H-indole-2-carboxamide is O=C(NCCCCCCO)c1cc2ccccc2[nH]1.
What is the InChIKey of N-(6-hydroxyhexyl)-1H-indole-2-carboxamide?
The InChIKey is GVXWRMNUFGFSQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c18-10-6-2-1-5-9-16-15(19)14-11-12-7-3-4-8-13(12)17-14/h3-4,7-8,11,17-18H,1-2,5-6,9-10H2,(H,16,19).
What are the key properties of N-(6-hydroxyhexyl)-1H-indole-2-carboxamide?
N-(6-hydroxyhexyl)-1H-indole-2-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 2.45, 7 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-hydroxyhexyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 11492630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).