N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine

C12H21N5 — CID 81001386

IUPACN-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCCc1nc(NN)c(C)c(N(CC)C2CC2)n1
InChIInChI=1S/C12H21N5/c1-4-10-14-11(16-13)8(3)12(15-10)17(5-2)9-6-7-9/h9H,4-7,13H2,1-3H3,(H,14,15,16)
InChIKeyKKMJPTQWNMPUBD-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.62
Rot. Bonds5

About N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine

N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine (PubChem CID 81001386) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine
PubChem CID81001386
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC NameN-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCCc1nc(NN)c(C)c(N(CC)C2CC2)n1
InChIInChI=1S/C12H21N5/c1-4-10-14-11(16-13)8(3)12(15-10)17(5-2)9-6-7-9/h9H,4-7,13H2,1-3H3,(H,14,15,16)
InChIKeyKKMJPTQWNMPUBD-UHFFFAOYSA-N
XLogP1.62
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.62
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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Related Compounds

N-cyclopropyl-N-ethyl-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80944707
2-ethyl-6-hydrazinyl-N,5-dimethyl-N-(4-methylcyclohexyl)pyrimidin-4-amine
CID 80994438
N-cyclopropyl-6-hydrazinyl-5-methyl-N-(2-methylpropyl)-2-propylpyrimidin-4-amine
CID 81006373
N-(cyclobutylmethyl)-2-ethyl-6-hydrazinyl-N,5-dimethylpyrimidin-4-amine
CID 81006190
3-[cyclobutyl-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)amino]propan-1-ol
CID 102875785
4-N-cyclopropyl-6-N,2-diethyl-5-methyl-4-N-(2,2,2-trifluoroethyl)pyrimidine-4,6-diamine
CID 80983604
N-cyclopropyl-N-(cyclopropylmethyl)-6-hydrazinyl-2,5-dimethylpyrimidin-4-amine
CID 80917857
N-cyclopropyl-6-hydrazinyl-5-methyl-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80995786
N,2-diethyl-6-hydrazinyl-N-(2-methoxyethyl)-5-methylpyrimidin-4-amine
CID 80994825
2-ethyl-6-hydrazinyl-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine
CID 80994434
2-ethyl-6-hydrazinyl-N,5-dimethyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 80995206
3-[cyclopropyl-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanenitrile
CID 80994835

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
The IUPAC name of N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine (CID 81001386) is N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
The canonical SMILES for N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine is CCc1nc(NN)c(C)c(N(CC)C2CC2)n1.
What is the InChIKey of N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
The InChIKey is KKMJPTQWNMPUBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-4-10-14-11(16-13)8(3)12(15-10)17(5-2)9-6-7-9/h9H,4-7,13H2,1-3H3,(H,14,15,16).
What are the key properties of N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine has a molecular weight of 235.33 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N,2-diethyl-6-hydrazinyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 81001386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).