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

C11H20N6O — CID 80922854

IUPAC6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine
SMILESCc1c(NN)ncnc1NCC1CN(C)CCO1
InChIInChI=1S/C11H20N6O/c1-8-10(14-7-15-11(8)16-12)13-5-9-6-17(2)3-4-18-9/h7,9H,3-6,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyAKHAFQWNTWVUGF-UHFFFAOYSA-N
MW252.32 g/mol
LogP-0.19
Rot. Bonds4

About 6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine

6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine (PubChem CID 80922854) has the molecular formula C11H20N6O and a molecular weight of 252.32 g/mol. Its IUPAC name is 6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine
PubChem CID80922854
Molecular FormulaC11H20N6O
Molecular Weight252.32 g/mol
Exact Mass252.17
IUPAC Name6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine
SMILESCc1c(NN)ncnc1NCC1CN(C)CCO1
InChIInChI=1S/C11H20N6O/c1-8-10(14-7-15-11(8)16-12)13-5-9-6-17(2)3-4-18-9/h7,9H,3-6,12H2,1-2H3,(H2,13,14,15,16)
InChIKeyAKHAFQWNTWVUGF-UHFFFAOYSA-N
XLogP-0.19
TPSA88.33 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 5-0.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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 6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine (CID 80922854) is 6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine is Cc1c(NN)ncnc1NCC1CN(C)CCO1.
What is the InChIKey of 6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is AKHAFQWNTWVUGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O/c1-8-10(14-7-15-11(8)16-12)13-5-9-6-17(2)3-4-18-9/h7,9H,3-6,12H2,1-2H3,(H2,13,14,15,16).
What are the key properties of 6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine?
6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 252.32 g/mol, XLogP of -0.19, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 80922854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).