5-(4-methylindol-1-yl)pentanehydrazide

C14H19N3O — CID 55214450

IUPAC5-(4-methylindol-1-yl)pentanehydrazide
SMILESCc1cccc2c1ccn2CCCCC(=O)NN
InChIInChI=1S/C14H19N3O/c1-11-5-4-6-13-12(11)8-10-17(13)9-3-2-7-14(18)16-15/h4-6,8,10H,2-3,7,9,15H2,1H3,(H,16,18)
InChIKeyBNBBUOSBUZFQPR-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.11
Rot. Bonds5

About 5-(4-methylindol-1-yl)pentanehydrazide

5-(4-methylindol-1-yl)pentanehydrazide (PubChem CID 55214450) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 5-(4-methylindol-1-yl)pentanehydrazide.

Molecular Properties

Compound Name5-(4-methylindol-1-yl)pentanehydrazide
PubChem CID55214450
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name5-(4-methylindol-1-yl)pentanehydrazide
SMILESCc1cccc2c1ccn2CCCCC(=O)NN
InChIInChI=1S/C14H19N3O/c1-11-5-4-6-13-12(11)8-10-17(13)9-3-2-7-14(18)16-15/h4-6,8,10H,2-3,7,9,15H2,1H3,(H,16,18)
InChIKeyBNBBUOSBUZFQPR-UHFFFAOYSA-N
XLogP2.11
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(4-oxoquinolin-1-yl)pentanehydrazide
CID 63582620
4-(4-methylindol-1-yl)butan-1-amine
CID 43163516
3-(4-cyanoindol-1-yl)propanehydrazide
CID 107919610
5-(6-methylindol-1-yl)pentanehydrazide
CID 63577406
3-(4-methylindol-1-yl)-1-phenylpropan-1-one
CID 116691890
methyl 3-methyl-2-[3-(4-methylindol-1-yl)propanoylamino]butanoate
CID 118985854
N-ethyl-3-(4-methylindol-1-yl)propan-1-amine
CID 62562010
6-(4,6-dichloroindol-1-yl)hexanehydrazide
CID 103428130
3-(4-propoxyindol-1-yl)propanehydrazide
CID 83162357
1-(3-methoxypropyl)-4-methylindole
CID 116620203
N-tert-butyl-2-(4-methylindol-1-yl)acetamide
CID 116620352
2-(4-methylindol-1-yl)-N-pentan-3-ylacetamide
CID 116620187

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylindol-1-yl)pentanehydrazide?
The IUPAC name of 5-(4-methylindol-1-yl)pentanehydrazide (CID 55214450) is 5-(4-methylindol-1-yl)pentanehydrazide.
What is the SMILES notation for 5-(4-methylindol-1-yl)pentanehydrazide?
The canonical SMILES for 5-(4-methylindol-1-yl)pentanehydrazide is Cc1cccc2c1ccn2CCCCC(=O)NN.
What is the InChIKey of 5-(4-methylindol-1-yl)pentanehydrazide?
The InChIKey is BNBBUOSBUZFQPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-11-5-4-6-13-12(11)8-10-17(13)9-3-2-7-14(18)16-15/h4-6,8,10H,2-3,7,9,15H2,1H3,(H,16,18).
What are the key properties of 5-(4-methylindol-1-yl)pentanehydrazide?
5-(4-methylindol-1-yl)pentanehydrazide has a molecular weight of 245.33 g/mol, XLogP of 2.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylindol-1-yl)pentanehydrazide is sourced from PubChem (CID 55214450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).