N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide

C19H20N6O2 — CID 38793783

IUPACN'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide
SMILESO=C(NNC(=O)C1CCN(c2cnccn2)CC1)c1c[nH]c2ccccc12
InChIInChI=1S/C19H20N6O2/c26-18(13-5-9-25(10-6-13)17-12-20-7-8-21-17)23-24-19(27)15-11-22-16-4-2-1-3-14(15)16/h1-4,7-8,11-13,22H,5-6,9-10H2,(H,23,26)(H,24,27)
InChIKeyULRZYYWJZDRQKQ-UHFFFAOYSA-N
MW364.41 g/mol
LogP1.64
Rot. Bonds3

About N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide

N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide (PubChem CID 38793783) has the molecular formula C19H20N6O2 and a molecular weight of 364.41 g/mol. Its IUPAC name is N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide.

Molecular Properties

Compound NameN'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide
PubChem CID38793783
Molecular FormulaC19H20N6O2
Molecular Weight364.41 g/mol
Exact Mass364.16
IUPAC NameN'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide
SMILESO=C(NNC(=O)C1CCN(c2cnccn2)CC1)c1c[nH]c2ccccc12
InChIInChI=1S/C19H20N6O2/c26-18(13-5-9-25(10-6-13)17-12-20-7-8-21-17)23-24-19(27)15-11-22-16-4-2-1-3-14(15)16/h1-4,7-8,11-13,22H,5-6,9-10H2,(H,23,26)(H,24,27)
InChIKeyULRZYYWJZDRQKQ-UHFFFAOYSA-N
XLogP1.64
TPSA103.01 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide?
The IUPAC name of N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide (CID 38793783) is N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide.
What is the SMILES notation for N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide?
The canonical SMILES for N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide is O=C(NNC(=O)C1CCN(c2cnccn2)CC1)c1c[nH]c2ccccc12.
What is the InChIKey of N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide?
The InChIKey is ULRZYYWJZDRQKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O2/c26-18(13-5-9-25(10-6-13)17-12-20-7-8-21-17)23-24-19(27)15-11-22-16-4-2-1-3-14(15)16/h1-4,7-8,11-13,22H,5-6,9-10H2,(H,23,26)(H,24,27).
What are the key properties of N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide?
N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide has a molecular weight of 364.41 g/mol, XLogP of 1.64, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-pyrazin-2-ylpiperidine-4-carbonyl)-1H-indole-3-carbohydrazide is sourced from PubChem (CID 38793783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).