6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine

C11H21N5O — CID 102701988

IUPAC6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine
SMILESCOC(C)CNc1ncnc(NN)c1C(C)C
InChIInChI=1S/C11H21N5O/c1-7(2)9-10(13-5-8(3)17-4)14-6-15-11(9)16-12/h6-8H,5,12H2,1-4H3,(H2,13,14,15,16)
InChIKeyYXCOLLXXNQOESJ-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.33
Rot. Bonds6

About 6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine

6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine (PubChem CID 102701988) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is 6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine
PubChem CID102701988
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC Name6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine
SMILESCOC(C)CNc1ncnc(NN)c1C(C)C
InChIInChI=1S/C11H21N5O/c1-7(2)9-10(13-5-8(3)17-4)14-6-15-11(9)16-12/h6-8H,5,12H2,1-4H3,(H2,13,14,15,16)
InChIKeyYXCOLLXXNQOESJ-UHFFFAOYSA-N
XLogP1.33
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.33
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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Related Compounds

6-chloro-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine
CID 102699925
1-[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]-4-methylpentan-2-ol
CID 107159905
6-hydrazinyl-N-(2-piperidin-1-ylpropyl)-5-propan-2-ylpyrimidin-4-amine
CID 80900343
N-tert-butyl-6-hydrazinyl-5-propan-2-ylpyrimidin-4-amine
CID 80930410
6-N-ethyl-4-N-(2-methoxypropyl)-5-methylpyrimidine-4,6-diamine
CID 102701780
6-hydrazinyl-N,5-di(propan-2-yl)pyrimidin-4-amine
CID 80932454
5-[(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]pentan-2-ol
CID 106138739
4-N-(2-methoxypropyl)-5-propylpyrimidine-4,6-diamine
CID 102701914
6-hydrazinyl-N-(2-phenoxyethyl)-5-propan-2-ylpyrimidin-4-amine
CID 80902452
6-hydrazinyl-N-[(1-methylpiperidin-4-yl)methyl]-5-propan-2-ylpyrimidin-4-amine
CID 80902596
2-(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)-1,1-dimethylhydrazine
CID 83027639
6-hydrazinyl-N-[3-(methoxymethyl)phenyl]-5-propan-2-ylpyrimidin-4-amine
CID 80901261

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine (CID 102701988) is 6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine is COC(C)CNc1ncnc(NN)c1C(C)C.
What is the InChIKey of 6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine?
The InChIKey is YXCOLLXXNQOESJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-7(2)9-10(13-5-8(3)17-4)14-6-15-11(9)16-12/h6-8H,5,12H2,1-4H3,(H2,13,14,15,16).
What are the key properties of 6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine?
6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine has a molecular weight of 239.32 g/mol, XLogP of 1.33, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(2-methoxypropyl)-5-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 102701988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).