2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine

C15H30N6 — CID 80995334

IUPAC2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine
SMILESCc1c(NN)nc(C(C)C)nc1NC(CN(C)C)C(C)C
InChIInChI=1S/C15H30N6/c1-9(2)12(8-21(6)7)17-14-11(5)15(20-16)19-13(18-14)10(3)4/h9-10,12H,8,16H2,1-7H3,(H2,17,18,19,20)
InChIKeyJYLITASKSBKZJJ-UHFFFAOYSA-N
MW294.45 g/mol
LogP2.19
Rot. Bonds7

About 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine

2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine (PubChem CID 80995334) has the molecular formula C15H30N6 and a molecular weight of 294.45 g/mol. Its IUPAC name is 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine.

Molecular Properties

Compound Name2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine
PubChem CID80995334
Molecular FormulaC15H30N6
Molecular Weight294.45 g/mol
Exact Mass294.25
IUPAC Name2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine
SMILESCc1c(NN)nc(C(C)C)nc1NC(CN(C)C)C(C)C
InChIInChI=1S/C15H30N6/c1-9(2)12(8-21(6)7)17-14-11(5)15(20-16)19-13(18-14)10(3)4/h9-10,12H,8,16H2,1-7H3,(H2,17,18,19,20)
InChIKeyJYLITASKSBKZJJ-UHFFFAOYSA-N
XLogP2.19
TPSA79.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.45
LogP ≤ 52.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)amino]propan-1-ol
CID 80995792
2-N-(2-hydrazinyl-5-methylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 80898011
2-N-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 82950187
2-N-(6-hydrazinyl-3-nitro-2-pyridinyl)-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 80897107
6-hydrazinyl-N,5-dimethyl-N-(2-methylbutan-2-yl)-2-propan-2-ylpyrimidin-4-amine
CID 81007010
3-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)amino]-N,N-dimethylpropanamide
CID 81006974
6-hydrazinyl-5-methyl-2-propan-2-yl-N-(3,3,3-trifluoropropyl)pyrimidin-4-amine
CID 81006788
N-butyl-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81000479
2-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]propan-1-ol
CID 104557168
2-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]ethanol
CID 81001694
5-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-methylamino]pentan-1-ol
CID 107207600
(2S)-3-methyl-2-[[5-methyl-2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]butan-1-ol
CID 80992681

Frequently Asked Questions

What is the IUPAC name of 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine?
The IUPAC name of 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine (CID 80995334) is 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine.
What is the SMILES notation for 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine?
The canonical SMILES for 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine is Cc1c(NN)nc(C(C)C)nc1NC(CN(C)C)C(C)C.
What is the InChIKey of 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine?
The InChIKey is JYLITASKSBKZJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N6/c1-9(2)12(8-21(6)7)17-14-11(5)15(20-16)19-13(18-14)10(3)4/h9-10,12H,8,16H2,1-7H3,(H2,17,18,19,20).
What are the key properties of 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine?
2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine has a molecular weight of 294.45 g/mol, XLogP of 2.19, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)-1-N,1-N,3-trimethylbutane-1,2-diamine is sourced from PubChem (CID 80995334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).