N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine

C12H23N5 — CID 80944940

IUPACN',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine
SMILESCCN(CC)CCCNc1cccc(NN)n1
InChIInChI=1S/C12H23N5/c1-3-17(4-2)10-6-9-14-11-7-5-8-12(15-11)16-13/h5,7-8H,3-4,6,9-10,13H2,1-2H3,(H2,14,15,16)
InChIKeyHPHRHIRGSOJBOV-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.51
Rot. Bonds8

About N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine

N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine (PubChem CID 80944940) has the molecular formula C12H23N5 and a molecular weight of 237.35 g/mol. Its IUPAC name is N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine
PubChem CID80944940
Molecular FormulaC12H23N5
Molecular Weight237.35 g/mol
Exact Mass237.20
IUPAC NameN',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine
SMILESCCN(CC)CCCNc1cccc(NN)n1
InChIInChI=1S/C12H23N5/c1-3-17(4-2)10-6-9-14-11-7-5-8-12(15-11)16-13/h5,7-8H,3-4,6,9-10,13H2,1-2H3,(H2,14,15,16)
InChIKeyHPHRHIRGSOJBOV-UHFFFAOYSA-N
XLogP1.51
TPSA66.21 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'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

6-[3-(diethylamino)propylamino]pyridine-2-carbothioamide
CID 64588815
4-N-[3-(diethylamino)propyl]-6-hydrazinylpyrimidine-2,4-diamine
CID 80942866
4-[(6-hydrazinyl-2-pyridinyl)amino]butan-1-ol
CID 106847100
6-N-[2-(diethylamino)ethyl]pyridine-2,6-diamine
CID 10856706
N-(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-N',N'-diethylpropane-1,3-diamine
CID 80968725
N-(5-bromo-6-methyl-2-pyridinyl)-N',N'-diethylpropane-1,3-diamine
CID 106544023
6-hydrazinyl-N-(3-methylbutyl)pyridin-2-amine
CID 80931651
2-N,6-N-dipentylpyridine-2,6-diamine
CID 66709787
N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylpropane-1,3-diamine
CID 115372327
6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine
CID 80778351
4-N-[3-(diethylamino)propyl]-6-N-propylpyrimidine-2,4,6-triamine
CID 80778408
2-N-[3-(diethylamino)propyl]-6-propoxypyridine-2,5-diamine
CID 43261118

Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine?
The IUPAC name of N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine (CID 80944940) is N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine.
What is the SMILES notation for N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine?
The canonical SMILES for N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine is CCN(CC)CCCNc1cccc(NN)n1.
What is the InChIKey of N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine?
The InChIKey is HPHRHIRGSOJBOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5/c1-3-17(4-2)10-6-9-14-11-7-5-8-12(15-11)16-13/h5,7-8H,3-4,6,9-10,13H2,1-2H3,(H2,14,15,16).
What are the key properties of N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine?
N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine has a molecular weight of 237.35 g/mol, XLogP of 1.51, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-(6-hydrazinyl-2-pyridinyl)propane-1,3-diamine is sourced from PubChem (CID 80944940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).