N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine

C15H29N5O — CID 115506035

IUPACN-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine
SMILESCC(C)c1nc(NN)cc(OCCN(C(C)C)C(C)C)n1
InChIInChI=1S/C15H29N5O/c1-10(2)15-17-13(19-16)9-14(18-15)21-8-7-20(11(3)4)12(5)6/h9-12H,7-8,16H2,1-6H3,(H,17,18,19)
InChIKeyBMVXREFDWHTWBR-UHFFFAOYSA-N
MW295.43 g/mol
LogP2.38
Rot. Bonds8

About N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine

N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine (PubChem CID 115506035) has the molecular formula C15H29N5O and a molecular weight of 295.43 g/mol. Its IUPAC name is N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine
PubChem CID115506035
Molecular FormulaC15H29N5O
Molecular Weight295.43 g/mol
Exact Mass295.24
IUPAC NameN-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine
SMILESCC(C)c1nc(NN)cc(OCCN(C(C)C)C(C)C)n1
InChIInChI=1S/C15H29N5O/c1-10(2)15-17-13(19-16)9-14(18-15)21-8-7-20(11(3)4)12(5)6/h9-12H,7-8,16H2,1-6H3,(H,17,18,19)
InChIKeyBMVXREFDWHTWBR-UHFFFAOYSA-N
XLogP2.38
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 52.38
H-Bond Donors ≤ 52
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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Related Compounds

[2-propan-2-yl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-yl]hydrazine
CID 80979368
(2-propan-2-yl-6-prop-2-ynoxypyrimidin-4-yl)hydrazine
CID 80968837
[6-[(4-chlorophenyl)methoxy]-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80980065
6-[2-(dimethylamino)ethoxy]-N-ethyl-2-propan-2-ylpyrimidin-4-amine
CID 80963169
(6-butan-2-yloxy-2-propan-2-ylpyrimidin-4-yl)hydrazine
CID 80969257
N-[2-(2-hydrazinylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine
CID 115506033
6-[2-[di(propan-2-yl)amino]ethoxy]-N-methyl-2-methylsulfanylpyrimidin-4-amine
CID 115505931
6-[3-(dimethylamino)propoxy]-N-ethyl-2-propan-2-ylpyrimidin-4-amine
CID 80963365
6-hydrazinyl-N,N-bis(2-methoxyethyl)-2-propan-2-ylpyrimidin-4-amine
CID 80963989
[6-[(E)-3-phenylprop-2-enoxy]-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 80969533
[6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-propan-2-ylpyrimidin-4-yl]hydrazine
CID 102723712
N-(6-butoxy-2-propan-2-ylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 82454377

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine (CID 115506035) is N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine is CC(C)c1nc(NN)cc(OCCN(C(C)C)C(C)C)n1.
What is the InChIKey of N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine?
The InChIKey is BMVXREFDWHTWBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N5O/c1-10(2)15-17-13(19-16)9-14(18-15)21-8-7-20(11(3)4)12(5)6/h9-12H,7-8,16H2,1-6H3,(H,17,18,19).
What are the key properties of N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine?
N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine has a molecular weight of 295.43 g/mol, XLogP of 2.38, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-hydrazinyl-2-propan-2-ylpyrimidin-4-yl)oxyethyl]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 115506035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).