N-hydroxy-5-propyl-1H-indole-2-carboxamide

C12H14N2O2 — CID 155672558

IUPACN-hydroxy-5-propyl-1H-indole-2-carboxamide
SMILESCCCc1ccc2[nH]c(C(=O)NO)cc2c1
InChIInChI=1S/C12H14N2O2/c1-2-3-8-4-5-10-9(6-8)7-11(13-10)12(15)14-16/h4-7,13,16H,2-3H2,1H3,(H,14,15)
InChIKeyFFMYLGIEPFHCHO-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.24
Rot. Bonds3

About N-hydroxy-5-propyl-1H-indole-2-carboxamide

N-hydroxy-5-propyl-1H-indole-2-carboxamide (PubChem CID 155672558) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is N-hydroxy-5-propyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-hydroxy-5-propyl-1H-indole-2-carboxamide
PubChem CID155672558
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC NameN-hydroxy-5-propyl-1H-indole-2-carboxamide
SMILESCCCc1ccc2[nH]c(C(=O)NO)cc2c1
InChIInChI=1S/C12H14N2O2/c1-2-3-8-4-5-10-9(6-8)7-11(13-10)12(15)14-16/h4-7,13,16H,2-3H2,1H3,(H,14,15)
InChIKeyFFMYLGIEPFHCHO-UHFFFAOYSA-N
XLogP2.24
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-ethyl-5-propyl-1H-indole
CID 86257176
ethyl 5-(2-hydroxyethyl)-1H-indole-2-carboxylate
CID 68691266
5-ethyl-N-(2-formamidoethyl)-1H-indole-2-carboxamide
CID 145164495
4-oxo-6-propyl-1H-quinoline-2-carboxylic acid
CID 63375917
N-(5-bromo-6-methyl-2-pyridinyl)-5-ethyl-1H-indole-2-carboxamide
CID 2823644
5-(diethoxyphosphorylmethyl)-1H-indole-2-carboxylic acid
CID 155170345
N-[2-(4-fluorophenyl)ethyl]-5-methyl-1H-indole-2-carboxamide
CID 36704078
ethyl 5-(2-cyanoethyl)-1H-indole-2-carboxylate
CID 70096807
methyl 5-[(2R)-2-aminobutyl]-1H-indole-2-carboxylate
CID 59979274
5-N,5-N-dimethyl-2-N-propyl-1H-indole-2,5-dicarboxamide
CID 159082495
5-hydroxy-1H-indole-2-carbohydrazide
CID 10877952
N-[(4-acetamidophenyl)methyl]-5-bromo-1H-indole-2-carboxamide
CID 24678417

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-5-propyl-1H-indole-2-carboxamide?
The IUPAC name of N-hydroxy-5-propyl-1H-indole-2-carboxamide (CID 155672558) is N-hydroxy-5-propyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-hydroxy-5-propyl-1H-indole-2-carboxamide?
The canonical SMILES for N-hydroxy-5-propyl-1H-indole-2-carboxamide is CCCc1ccc2[nH]c(C(=O)NO)cc2c1.
What is the InChIKey of N-hydroxy-5-propyl-1H-indole-2-carboxamide?
The InChIKey is FFMYLGIEPFHCHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-2-3-8-4-5-10-9(6-8)7-11(13-10)12(15)14-16/h4-7,13,16H,2-3H2,1H3,(H,14,15).
What are the key properties of N-hydroxy-5-propyl-1H-indole-2-carboxamide?
N-hydroxy-5-propyl-1H-indole-2-carboxamide has a molecular weight of 218.26 g/mol, XLogP of 2.24, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-5-propyl-1H-indole-2-carboxamide is sourced from PubChem (CID 155672558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).