N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine

C11H19N5 — CID 80944707

IUPACN-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
SMILESCCN(c1nc(C)nc(NN)c1C)C1CC1
InChIInChI=1S/C11H19N5/c1-4-16(9-5-6-9)11-7(2)10(15-12)13-8(3)14-11/h9H,4-6,12H2,1-3H3,(H,13,14,15)
InChIKeyIRGPQBDPKBKLTN-UHFFFAOYSA-N
MW221.31 g/mol
LogP1.37
Rot. Bonds4

About N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine

N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine (PubChem CID 80944707) has the molecular formula C11H19N5 and a molecular weight of 221.31 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
PubChem CID80944707
Molecular FormulaC11H19N5
Molecular Weight221.31 g/mol
Exact Mass221.16
IUPAC NameN-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
SMILESCCN(c1nc(C)nc(NN)c1C)C1CC1
InChIInChI=1S/C11H19N5/c1-4-16(9-5-6-9)11-7(2)10(15-12)13-8(3)14-11/h9H,4-6,12H2,1-3H3,(H,13,14,15)
InChIKeyIRGPQBDPKBKLTN-UHFFFAOYSA-N
XLogP1.37
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.31
LogP ≤ 51.37
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 N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
The IUPAC name of N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine (CID 80944707) is N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
The canonical SMILES for N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine is CCN(c1nc(C)nc(NN)c1C)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
The InChIKey is IRGPQBDPKBKLTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5/c1-4-16(9-5-6-9)11-7(2)10(15-12)13-8(3)14-11/h9H,4-6,12H2,1-3H3,(H,13,14,15).
What are the key properties of N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine?
N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine has a molecular weight of 221.31 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 80944707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).