2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine

C11H19N5O — CID 80928984

IUPAC2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine
SMILESCc1cnc(NN)nc1NCC1(C)CCCO1
InChIInChI=1S/C11H19N5O/c1-8-6-13-10(16-12)15-9(8)14-7-11(2)4-3-5-17-11/h6H,3-5,7,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyFTSSDTTVJAUCKI-UHFFFAOYSA-N
MW237.31 g/mol
LogP1.05
Rot. Bonds4

About 2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine

2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine (PubChem CID 80928984) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine
PubChem CID80928984
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine
SMILESCc1cnc(NN)nc1NCC1(C)CCCO1
InChIInChI=1S/C11H19N5O/c1-8-6-13-10(16-12)15-9(8)14-7-11(2)4-3-5-17-11/h6H,3-5,7,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyFTSSDTTVJAUCKI-UHFFFAOYSA-N
XLogP1.05
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 51.05
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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Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine (CID 80928984) is 2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine is Cc1cnc(NN)nc1NCC1(C)CCCO1.
What is the InChIKey of 2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is FTSSDTTVJAUCKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-8-6-13-10(16-12)15-9(8)14-7-11(2)4-3-5-17-11/h6H,3-5,7,12H2,1-2H3,(H2,13,14,15,16).
What are the key properties of 2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine?
2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 237.31 g/mol, XLogP of 1.05, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-5-methyl-N-[(2-methyloxolan-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 80928984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).