N-propylbutanehydrazide

C7H16N2O — CID 165487733

IUPACN-propylbutanehydrazide
SMILESCCCC(=O)N(N)CCC
InChIInChI=1S/C7H16N2O/c1-3-5-7(10)9(8)6-4-2/h3-6,8H2,1-2H3
InChIKeyYFPBUFCDQJNZOJ-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.90
Rot. Bonds4

About N-propylbutanehydrazide

N-propylbutanehydrazide (PubChem CID 165487733) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is N-propylbutanehydrazide.

Molecular Properties

Compound NameN-propylbutanehydrazide
PubChem CID165487733
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC NameN-propylbutanehydrazide
SMILESCCCC(=O)N(N)CCC
InChIInChI=1S/C7H16N2O/c1-3-5-7(10)9(8)6-4-2/h3-6,8H2,1-2H3
InChIKeyYFPBUFCDQJNZOJ-UHFFFAOYSA-N
XLogP0.90
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-butylpentanehydrazide
CID 22613544
N-(aminomethyl)-N-methylbutanamide
CID 155070465
N-(2-amino-2-oxoethyl)-N-propylbutanamide
CID 57237794
amino N-amino-N-propylcarbamate
CID 57295452
N-tert-butylbutanehydrazide
CID 70295637
1-N-dodecyl-4-N',4-N'-diethyl-4-N-propylbutanedihydrazide
CID 150394471
N-(2-bromoethyl)-N-methylbutanamide
CID 80658424
2-[butanoyl(methyl)amino]ethyl acetate
CID 153197952
N,N-dibromobutanamide
CID 154147629
N,N-dimethylbutanamide;hydrochloride
CID 87498306
N,N-bis(2-hydroxyethyl)butanamide
CID 14455174
N-(3-aminopropyl)-N-propan-2-ylbutanamide
CID 43136655

Frequently Asked Questions

What is the IUPAC name of N-propylbutanehydrazide?
The IUPAC name of N-propylbutanehydrazide (CID 165487733) is N-propylbutanehydrazide.
What is the SMILES notation for N-propylbutanehydrazide?
The canonical SMILES for N-propylbutanehydrazide is CCCC(=O)N(N)CCC.
What is the InChIKey of N-propylbutanehydrazide?
The InChIKey is YFPBUFCDQJNZOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-3-5-7(10)9(8)6-4-2/h3-6,8H2,1-2H3.
What are the key properties of N-propylbutanehydrazide?
N-propylbutanehydrazide has a molecular weight of 144.22 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propylbutanehydrazide is sourced from PubChem (CID 165487733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).