6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine

C12H24N8 — CID 80896860

IUPAC6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
SMILESCC(CN1CCCC1)Nc1nc(NN)nc(N(C)C)n1
InChIInChI=1S/C12H24N8/c1-9(8-20-6-4-5-7-20)14-10-15-11(18-13)17-12(16-10)19(2)3/h9H,4-8,13H2,1-3H3,(H2,14,15,16,17,18)
InChIKeyMPGRWSIFTXYPJL-UHFFFAOYSA-N
MW280.38 g/mol
LogP0.12
Rot. Bonds6

About 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine

6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 80896860) has the molecular formula C12H24N8 and a molecular weight of 280.38 g/mol. Its IUPAC name is 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
PubChem CID80896860
Molecular FormulaC12H24N8
Molecular Weight280.38 g/mol
Exact Mass280.21
IUPAC Name6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
SMILESCC(CN1CCCC1)Nc1nc(NN)nc(N(C)C)n1
InChIInChI=1S/C12H24N8/c1-9(8-20-6-4-5-7-20)14-10-15-11(18-13)17-12(16-10)19(2)3/h9H,4-8,13H2,1-3H3,(H2,14,15,16,17,18)
InChIKeyMPGRWSIFTXYPJL-UHFFFAOYSA-N
XLogP0.12
TPSA95.23 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

6-hydrazinyl-4-N,4-N-dimethyl-2-N-(6-methylheptan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80897844
6-chloro-4-N-methyl-2-N-(1-piperidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80801538
3-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]amino]-2-methylsulfanylbutan-1-ol
CID 106163716
4-ethoxy-6-hydrazinyl-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine
CID 80901228
6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80800739
6-hydrazinyl-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 80897697
6-hydrazinyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrazin-2-amine
CID 80897850
6-hydrazinyl-2,5-dimethyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 80897399
6-ethoxy-4-N-methyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80800577
6-hydrazinyl-N-(1-pyrrolidin-1-ylpropan-2-yl)-4-(trifluoromethyl)pyridin-2-amine
CID 102720566
6-hydrazinyl-4-N,4-N-dimethyl-2-N-(3-methyl-2-propan-2-ylbutyl)-1,3,5-triazine-2,4-diamine
CID 102909000
2-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]amino]-N-methylpropanamide
CID 80896911

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine (CID 80896860) is 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine is CC(CN1CCCC1)Nc1nc(NN)nc(N(C)C)n1.
What is the InChIKey of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is MPGRWSIFTXYPJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N8/c1-9(8-20-6-4-5-7-20)14-10-15-11(18-13)17-12(16-10)19(2)3/h9H,4-8,13H2,1-3H3,(H2,14,15,16,17,18).
What are the key properties of 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine?
6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 280.38 g/mol, XLogP of 0.12, 6 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80896860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).