N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide

C15H17N3O2 — CID 29437842

IUPACN'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide
SMILESO=C(Cc1c[nH]c2ccccc12)NNC(=O)C1CCC1
InChIInChI=1S/C15H17N3O2/c19-14(17-18-15(20)10-4-3-5-10)8-11-9-16-13-7-2-1-6-12(11)13/h1-2,6-7,9-10,16H,3-5,8H2,(H,17,19)(H,18,20)
InChIKeyCHTNWTWXTPQURQ-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.66
Rot. Bonds3

About N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide

N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide (PubChem CID 29437842) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide.

Molecular Properties

Compound NameN'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide
PubChem CID29437842
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide
SMILESO=C(Cc1c[nH]c2ccccc12)NNC(=O)C1CCC1
InChIInChI=1S/C15H17N3O2/c19-14(17-18-15(20)10-4-3-5-10)8-11-9-16-13-7-2-1-6-12(11)13/h1-2,6-7,9-10,16H,3-5,8H2,(H,17,19)(H,18,20)
InChIKeyCHTNWTWXTPQURQ-UHFFFAOYSA-N
XLogP1.66
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(1H-indol-3-yl)acetyl]cyclohex-3-ene-1-carbohydrazide
CID 46656997
1-cyclopentyl-2-(1H-indol-3-yl)ethanone
CID 126509630
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
N'-[2-(1H-indol-3-yl)acetyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide
CID 42905192
N-cyclopentyloxy-2-(1H-indol-3-yl)acetamide
CID 83202752
N'-[2-(1H-indol-3-yl)acetyl]-3-methylsulfanylpropanehydrazide
CID 18164303
4-(1H-indol-3-yl)-N'-[2-(1H-indol-3-yl)acetyl]butanehydrazide
CID 29437828
2-(2-bicyclo[2.2.1]heptanyl)-N'-[2-(1H-indol-3-yl)acetyl]acetohydrazide
CID 51166897
1-[[2-(1H-indol-3-yl)acetyl]amino]-3-phenylurea
CID 5058781
2-(1H-indol-3-yl)-N-[(2-methylcyclopentyl)methyl]acetamide
CID 107420241
N'-[2-(1H-indol-3-yl)acetyl]-4-(2-methylpiperidin-1-yl)sulfonylbenzohydrazide
CID 55351992
2-(1H-indol-3-yl)-N'-(2-phenylmethoxyacetyl)acetohydrazide
CID 102603627

Frequently Asked Questions

What is the IUPAC name of N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide?
The IUPAC name of N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide (CID 29437842) is N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide.
What is the SMILES notation for N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide?
The canonical SMILES for N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide is O=C(Cc1c[nH]c2ccccc12)NNC(=O)C1CCC1.
What is the InChIKey of N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide?
The InChIKey is CHTNWTWXTPQURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c19-14(17-18-15(20)10-4-3-5-10)8-11-9-16-13-7-2-1-6-12(11)13/h1-2,6-7,9-10,16H,3-5,8H2,(H,17,19)(H,18,20).
What are the key properties of N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide?
N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide has a molecular weight of 271.32 g/mol, XLogP of 1.66, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide is sourced from PubChem (CID 29437842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).