N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide

C15H20N4O — CID 63747724

IUPACN-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide
SMILESO=C(NCCN1CCNCC1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C15H20N4O/c20-15(18-7-10-19-8-5-16-6-9-19)13-1-2-14-12(11-13)3-4-17-14/h1-4,11,16-17H,5-10H2,(H,18,20)
InChIKeyWIUUIDJVQAFXOB-UHFFFAOYSA-N
MW272.35 g/mol
LogP0.80
Rot. Bonds4

About N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide

N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide (PubChem CID 63747724) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide
PubChem CID63747724
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide
SMILESO=C(NCCN1CCNCC1)c1ccc2[nH]ccc2c1
InChIInChI=1S/C15H20N4O/c20-15(18-7-10-19-8-5-16-6-9-19)13-1-2-14-12(11-13)3-4-17-14/h1-4,11,16-17H,5-10H2,(H,18,20)
InChIKeyWIUUIDJVQAFXOB-UHFFFAOYSA-N
XLogP0.80
TPSA60.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-N-(2-piperazin-1-ylethyl)benzamide
CID 10753244
N-(2-piperazin-1-ylethyl)-1-benzothiophene-5-carboxamide
CID 119446532
3-bromo-4-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 81471524
3-hydroxy-N-(2-piperazin-1-ylethyl)benzamide
CID 43600333
3-bromo-4-chloro-N-(2-piperazin-1-ylethyl)benzamide
CID 107990091
N-(2-piperazin-1-ylethyl)quinoline-6-carboxamide
CID 62875225
N-(piperidin-4-ylmethyl)-1H-indole-5-carboxamide
CID 63747736
4-chloro-3-iodo-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
CID 119449000
3-chloro-4-iodo-N-(2-piperazin-1-ylethyl)benzamide;hydrochloride
CID 119448751
N-[3-(methylamino)propyl]-1H-indole-5-carboxamide
CID 63749863
N-(3-methylsulfinylpropyl)-1H-indole-5-carboxamide
CID 115621267
4-methyl-3-methylsulfonyl-N-(2-piperazin-1-ylethyl)benzamide
CID 119446273

Frequently Asked Questions

What is the IUPAC name of N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide?
The IUPAC name of N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide (CID 63747724) is N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide.
What is the SMILES notation for N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide?
The canonical SMILES for N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide is O=C(NCCN1CCNCC1)c1ccc2[nH]ccc2c1.
What is the InChIKey of N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide?
The InChIKey is WIUUIDJVQAFXOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c20-15(18-7-10-19-8-5-16-6-9-19)13-1-2-14-12(11-13)3-4-17-14/h1-4,11,16-17H,5-10H2,(H,18,20).
What are the key properties of N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide?
N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 0.80, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperazin-1-ylethyl)-1H-indole-5-carboxamide is sourced from PubChem (CID 63747724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).