N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine

C11H22N6 — CID 80969220

IUPACN-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
SMILESCC(C)c1nc(NN)cc(NCCN(C)C)n1
InChIInChI=1S/C11H22N6/c1-8(2)11-14-9(7-10(15-11)16-12)13-5-6-17(3)4/h7-8H,5-6,12H2,1-4H3,(H2,13,14,15,16)
InChIKeyYQRHTTFWXHKSKF-UHFFFAOYSA-N
MW238.34 g/mol
LogP0.86
Rot. Bonds6

About N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine

N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine (PubChem CID 80969220) has the molecular formula C11H22N6 and a molecular weight of 238.34 g/mol. Its IUPAC name is N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
PubChem CID80969220
Molecular FormulaC11H22N6
Molecular Weight238.34 g/mol
Exact Mass238.19
IUPAC NameN-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
SMILESCC(C)c1nc(NN)cc(NCCN(C)C)n1
InChIInChI=1S/C11H22N6/c1-8(2)11-14-9(7-10(15-11)16-12)13-5-6-17(3)4/h7-8H,5-6,12H2,1-4H3,(H2,13,14,15,16)
InChIKeyYQRHTTFWXHKSKF-UHFFFAOYSA-N
XLogP0.86
TPSA79.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.34
LogP ≤ 50.86
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'}

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Launch Full Analysis

Related Compounds

N',N'-dimethyl-N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine
CID 43395227
4-N-[2-(dimethylamino)ethyl]-6-hydrazinylpyrimidine-2,4-diamine
CID 80932754
6-hydrazinyl-N-(3-methylbutyl)-2-propan-2-ylpyrimidin-4-amine
CID 80969046
N-(6-ethoxy-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 82453924
6-[2-(dimethylamino)ethylamino]-2-propan-2-ylpyrimidine-4-carboxylic acid
CID 95462594
4-N-[4-(dimethylamino)butyl]-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80967029
6-hydrazinyl-N-(2-phenylethyl)-2-propan-2-ylpyrimidin-4-amine
CID 80968187
N-(6-butoxy-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 82454377
N-(6-chloro-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylpropane-1,3-diamine
CID 80953327
N-ethyl-2-[(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)amino]-N-methylacetamide
CID 114133543
N-[[1-(dimethylamino)cyclobutyl]methyl]-6-hydrazinyl-2-propan-2-ylpyrimidin-4-amine
CID 105421023
N-(2-ethyl-6-hydrazinylpyrimidin-4-yl)-N'-methyl-N'-propan-2-ylethane-1,2-diamine
CID 80937853

Frequently Asked Questions

What is the IUPAC name of N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine (CID 80969220) is N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine is CC(C)c1nc(NN)cc(NCCN(C)C)n1.
What is the InChIKey of N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine?
The InChIKey is YQRHTTFWXHKSKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N6/c1-8(2)11-14-9(7-10(15-11)16-12)13-5-6-17(3)4/h7-8H,5-6,12H2,1-4H3,(H2,13,14,15,16).
What are the key properties of N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine?
N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine has a molecular weight of 238.34 g/mol, XLogP of 0.86, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 80969220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).