N,N'-dipropylprop-2-enehydrazide

C9H18N2O — CID 87503938

IUPACN,N'-dipropylprop-2-enehydrazide
SMILESC=CC(=O)N(CCC)NCCC
InChIInChI=1S/C9H18N2O/c1-4-7-10-11(8-5-2)9(12)6-3/h6,10H,3-5,7-8H2,1-2H3
InChIKeyCEZDMQBSIWHXLZ-UHFFFAOYSA-N
MW170.26 g/mol
LogP1.33
Rot. Bonds6

About N,N'-dipropylprop-2-enehydrazide

N,N'-dipropylprop-2-enehydrazide (PubChem CID 87503938) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N,N'-dipropylprop-2-enehydrazide.

Molecular Properties

Compound NameN,N'-dipropylprop-2-enehydrazide
PubChem CID87503938
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN,N'-dipropylprop-2-enehydrazide
SMILESC=CC(=O)N(CCC)NCCC
InChIInChI=1S/C9H18N2O/c1-4-7-10-11(8-5-2)9(12)6-3/h6,10H,3-5,7-8H2,1-2H3
InChIKeyCEZDMQBSIWHXLZ-UHFFFAOYSA-N
XLogP1.33
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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N-propylpropan-1-amine;N-propylprop-2-enamide
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CID 21689825
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CID 21881833
N-ethylethanamine;N-propylprop-2-enamide
CID 22381541
N-ethylprop-2-enamide;N-propylpropan-1-amine
CID 22596667
N,N'-dimethylprop-2-enehydrazide
CID 23183837
N'-methyl-N'-propylprop-2-enehydrazide
CID 23187780
N'-tert-butyl-N-propylprop-2-enehydrazide
CID 53914607

Frequently Asked Questions

What is the IUPAC name of N,N'-dipropylprop-2-enehydrazide?
The IUPAC name of N,N'-dipropylprop-2-enehydrazide (CID 87503938) is N,N'-dipropylprop-2-enehydrazide.
What is the SMILES notation for N,N'-dipropylprop-2-enehydrazide?
The canonical SMILES for N,N'-dipropylprop-2-enehydrazide is C=CC(=O)N(CCC)NCCC.
What is the InChIKey of N,N'-dipropylprop-2-enehydrazide?
The InChIKey is CEZDMQBSIWHXLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-4-7-10-11(8-5-2)9(12)6-3/h6,10H,3-5,7-8H2,1-2H3.
What are the key properties of N,N'-dipropylprop-2-enehydrazide?
N,N'-dipropylprop-2-enehydrazide has a molecular weight of 170.26 g/mol, XLogP of 1.33, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dipropylprop-2-enehydrazide is sourced from PubChem (CID 87503938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).