N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine

C12H23N5 — CID 80896175

IUPACN-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine
SMILESCCC(CC)CN(CC)c1cc(NN)ncn1
InChIInChI=1S/C12H23N5/c1-4-10(5-2)8-17(6-3)12-7-11(16-13)14-9-15-12/h7,9-10H,4-6,8,13H2,1-3H3,(H,14,15,16)
InChIKeyOMFCHPMKNLNCNM-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.02
Rot. Bonds7

About N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine

N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine (PubChem CID 80896175) has the molecular formula C12H23N5 and a molecular weight of 237.35 g/mol. Its IUPAC name is N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine
PubChem CID80896175
Molecular FormulaC12H23N5
Molecular Weight237.35 g/mol
Exact Mass237.20
IUPAC NameN-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine
SMILESCCC(CC)CN(CC)c1cc(NN)ncn1
InChIInChI=1S/C12H23N5/c1-4-10(5-2)8-17(6-3)12-7-11(16-13)14-9-15-12/h7,9-10H,4-6,8,13H2,1-3H3,(H,14,15,16)
InChIKeyOMFCHPMKNLNCNM-UHFFFAOYSA-N
XLogP2.02
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.02
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

4-N-ethyl-4-N-(2-ethylbutyl)-6-hydrazinylpyrimidine-2,4-diamine
CID 80895944
6-hydrazinyl-N,N-dipropylpyrimidin-4-amine
CID 80932802
N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyridin-2-amine
CID 80895786
4-N,4-N-diethyl-6-N-methylpyrimidine-4,6-diamine
CID 80767008
6-hydrazinyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-4-amine
CID 80904438
N-ethyl-6-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]pyrimidin-4-amine
CID 80926425
6-hydrazinyl-N-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 80902323
4-N-ethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
CID 80776167
N-ethyl-N-(2-fluorophenyl)-6-hydrazinylpyrimidin-4-amine
CID 80908328
N-cyclopropyl-6-hydrazinyl-N-propylpyrimidin-4-amine
CID 80895552
N-ethyl-N-(2-ethylbutyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379566
N-ethyl-N-(2-ethylbutyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 80895945

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine?
The IUPAC name of N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine (CID 80896175) is N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine is CCC(CC)CN(CC)c1cc(NN)ncn1.
What is the InChIKey of N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine?
The InChIKey is OMFCHPMKNLNCNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5/c1-4-10(5-2)8-17(6-3)12-7-11(16-13)14-9-15-12/h7,9-10H,4-6,8,13H2,1-3H3,(H,14,15,16).
What are the key properties of N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine?
N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine has a molecular weight of 237.35 g/mol, XLogP of 2.02, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-ethylbutyl)-6-hydrazinylpyrimidin-4-amine is sourced from PubChem (CID 80896175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).