N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine

C13H25N5 — CID 80896487

IUPACN-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCCC(CC)CN(CC)c1nc(NN)ncc1C
InChIInChI=1S/C13H25N5/c1-5-11(6-2)9-18(7-3)12-10(4)8-15-13(16-12)17-14/h8,11H,5-7,9,14H2,1-4H3,(H,15,16,17)
InChIKeyKSTWISDCUXOIHA-UHFFFAOYSA-N
MW251.38 g/mol
LogP2.33
Rot. Bonds7

About N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine

N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine (PubChem CID 80896487) has the molecular formula C13H25N5 and a molecular weight of 251.38 g/mol. Its IUPAC name is N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine
PubChem CID80896487
Molecular FormulaC13H25N5
Molecular Weight251.38 g/mol
Exact Mass251.21
IUPAC NameN-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCCC(CC)CN(CC)c1nc(NN)ncc1C
InChIInChI=1S/C13H25N5/c1-5-11(6-2)9-18(7-3)12-10(4)8-15-13(16-12)17-14/h8,11H,5-7,9,14H2,1-4H3,(H,15,16,17)
InChIKeyKSTWISDCUXOIHA-UHFFFAOYSA-N
XLogP2.33
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.38
LogP ≤ 52.33
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

2-[(2-hydrazinyl-5-methylpyrimidin-4-yl)-propylamino]ethanol
CID 80896004
5-chloro-2-N,4-N-diethyl-4-N-(2-ethylbutyl)pyrimidine-2,4-diamine
CID 80799979
2-N,4-N,4-N-triethyl-5-methylpyrimidine-2,4-diamine
CID 80766610
4-N-ethyl-4-N-(2-ethylbutyl)-5-fluoro-2-N-propylpyrimidine-2,4-diamine
CID 80799829
3-[ethyl-[2-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanenitrile
CID 80805778
5-(aminomethyl)-N-ethyl-N-(2-ethylbutyl)-3-methylpyridin-2-amine
CID 80629781
5-(2-aminoethyl)-N-ethyl-N-(2-ethylbutyl)-3-methylpyridin-2-amine
CID 80634153
N-ethyl-N-(2-ethylbutyl)-5-(methylaminomethyl)pyrimidin-4-amine
CID 114216105
2-[ethyl-[5-methyl-2-(methylamino)pyrimidin-4-yl]amino]ethanol
CID 80790817
4-N-ethyl-2-N,5-dimethyl-4-N-(2,2,2-trifluoroethyl)pyrimidine-2,4-diamine
CID 80815496
N-ethyl-N-(2-ethylbutyl)-6-hydrazinylimidazo[1,2-a]pyrazin-8-amine
CID 80895945
N-ethyl-N-(2-ethylbutyl)-3-methyl-5-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 80632647

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine?
The IUPAC name of N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine (CID 80896487) is N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine is CCC(CC)CN(CC)c1nc(NN)ncc1C.
What is the InChIKey of N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine?
The InChIKey is KSTWISDCUXOIHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N5/c1-5-11(6-2)9-18(7-3)12-10(4)8-15-13(16-12)17-14/h8,11H,5-7,9,14H2,1-4H3,(H,15,16,17).
What are the key properties of N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine?
N-ethyl-N-(2-ethylbutyl)-2-hydrazinyl-5-methylpyrimidin-4-amine has a molecular weight of 251.38 g/mol, XLogP of 2.33, 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)-2-hydrazinyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80896487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).