2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine

C11H21N5 — CID 80904714

IUPAC2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine
SMILESCC(C)CN(c1ccnc(NN)n1)C(C)C
InChIInChI=1S/C11H21N5/c1-8(2)7-16(9(3)4)10-5-6-13-11(14-10)15-12/h5-6,8-9H,7,12H2,1-4H3,(H,13,14,15)
InChIKeyHPWYRBKZDVDBHG-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.63
Rot. Bonds5

About 2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine

2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine (PubChem CID 80904714) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine
PubChem CID80904714
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC Name2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine
SMILESCC(C)CN(c1ccnc(NN)n1)C(C)C
InChIInChI=1S/C11H21N5/c1-8(2)7-16(9(3)4)10-5-6-13-11(14-10)15-12/h5-6,8-9H,7,12H2,1-4H3,(H,13,14,15)
InChIKeyHPWYRBKZDVDBHG-UHFFFAOYSA-N
XLogP1.63
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine (CID 80904714) is 2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine is CC(C)CN(c1ccnc(NN)n1)C(C)C.
What is the InChIKey of 2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine?
The InChIKey is HPWYRBKZDVDBHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5/c1-8(2)7-16(9(3)4)10-5-6-13-11(14-10)15-12/h5-6,8-9H,7,12H2,1-4H3,(H,13,14,15).
What are the key properties of 2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine?
2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine has a molecular weight of 223.32 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 80904714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).