4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine

C13H25N7 — CID 80928977

IUPAC4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
SMILESCCN(CC)c1nc(NN)nc(N2CCC(C)(C)C2)n1
InChIInChI=1S/C13H25N7/c1-5-19(6-2)11-15-10(18-14)16-12(17-11)20-8-7-13(3,4)9-20/h5-9,14H2,1-4H3,(H,15,16,17,18)
InChIKeyFGQUIAXQNIIBBH-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.24
Rot. Bonds5

About 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine

4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine (PubChem CID 80928977) has the molecular formula C13H25N7 and a molecular weight of 279.39 g/mol. Its IUPAC name is 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
PubChem CID80928977
Molecular FormulaC13H25N7
Molecular Weight279.39 g/mol
Exact Mass279.22
IUPAC Name4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
SMILESCCN(CC)c1nc(NN)nc(N2CCC(C)(C)C2)n1
InChIInChI=1S/C13H25N7/c1-5-19(6-2)11-15-10(18-14)16-12(17-11)20-8-7-13(3,4)9-20/h5-9,14H2,1-4H3,(H,15,16,17,18)
InChIKeyFGQUIAXQNIIBBH-UHFFFAOYSA-N
XLogP1.24
TPSA83.20 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine with MolForge

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Related Compounds

4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
CID 104961882
6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine
CID 80824382
[4-(4,4-dimethylpiperidin-1-yl)-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 80905338
4-N,4-N-diethyl-6-hydrazinyl-2-N-[(1-methylcyclopentyl)methyl]-1,3,5-triazine-2,4-diamine
CID 80906512
4-(2-azaspiro[4.4]nonan-2-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 114279647
2-N-(2,2-dimethylcyclopentyl)-4-N,4-N-diethyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
CID 80929643
[4-(3,3-diethylpyrrolidin-1-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
CID 80929797
N-ethyl-4-hydrazinyl-6-piperidin-1-yl-N-propan-2-yl-1,3,5-triazin-2-amine
CID 80944115
[4-(4,4-dimethylpiperidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
CID 80919495
2-[[4-(diethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-ethylamino]ethanol
CID 80899174
2-[[4-(diethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-ethylamino]-N-methylacetamide
CID 80900599
4-(3,3-dimethylpyrrolidin-1-yl)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80854586

Frequently Asked Questions

What is the IUPAC name of 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine (CID 80928977) is 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine is CCN(CC)c1nc(NN)nc(N2CCC(C)(C)C2)n1.
What is the InChIKey of 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine?
The InChIKey is FGQUIAXQNIIBBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N7/c1-5-19(6-2)11-15-10(18-14)16-12(17-11)20-8-7-13(3,4)9-20/h5-9,14H2,1-4H3,(H,15,16,17,18).
What are the key properties of 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine?
4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine has a molecular weight of 279.39 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80928977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).