6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine

C13H25N5 — CID 80906528

IUPAC6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine
SMILESCCCc1c(NN)ncnc1N(C)C(C)CCC
InChIInChI=1S/C13H25N5/c1-5-7-10(3)18(4)13-11(8-6-2)12(17-14)15-9-16-13/h9-10H,5-8,14H2,1-4H3,(H,15,16,17)
InChIKeyMSOHNRHWJKBLNR-UHFFFAOYSA-N
MW251.38 g/mol
LogP2.34
Rot. Bonds7

About 6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine

6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine (PubChem CID 80906528) has the molecular formula C13H25N5 and a molecular weight of 251.38 g/mol. Its IUPAC name is 6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine
PubChem CID80906528
Molecular FormulaC13H25N5
Molecular Weight251.38 g/mol
Exact Mass251.21
IUPAC Name6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine
SMILESCCCc1c(NN)ncnc1N(C)C(C)CCC
InChIInChI=1S/C13H25N5/c1-5-7-10(3)18(4)13-11(8-6-2)12(17-14)15-9-16-13/h9-10H,5-8,14H2,1-4H3,(H,15,16,17)
InChIKeyMSOHNRHWJKBLNR-UHFFFAOYSA-N
XLogP2.34
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 ≤ 52.34
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-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-methylamino]propan-1-ol
CID 104557148
6-hydrazinyl-N,N-dimethyl-5-propylpyrimidin-4-amine
CID 80932720
N-(1-cyclopropylethyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine
CID 80906264
4-N-butan-2-yl-6-N-ethyl-4-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80775365
3-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-methylamino]propanenitrile
CID 80916482
6-N-ethyl-4-N,5-dimethyl-4-N-pentan-2-ylpyrimidine-4,6-diamine
CID 80792480
3-[[6-(ethylamino)-5-propylpyrimidin-4-yl]-methylamino]butanenitrile
CID 80829044
3-N-(6-hydrazinyl-5-propylpyrimidin-4-yl)-1-N,1-N-dimethylbutane-1,3-diamine
CID 80904538
3-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-(2-methylpropyl)amino]propanenitrile
CID 80900553
5-ethyl-6-hydrazinyl-N-methyl-N-pentan-3-ylpyrimidin-4-amine
CID 80906749
N-(4-fluorophenyl)-6-hydrazinyl-N-methyl-5-propylpyrimidin-4-amine
CID 80908843
2-[(6-hydrazinyl-5-propylpyrimidin-4-yl)-methylamino]-N,N-dimethylacetamide
CID 80894743

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine (CID 80906528) is 6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine is CCCc1c(NN)ncnc1N(C)C(C)CCC.
What is the InChIKey of 6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine?
The InChIKey is MSOHNRHWJKBLNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N5/c1-5-7-10(3)18(4)13-11(8-6-2)12(17-14)15-9-16-13/h9-10H,5-8,14H2,1-4H3,(H,15,16,17).
What are the key properties of 6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine?
6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine has a molecular weight of 251.38 g/mol, XLogP of 2.34, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-methyl-N-pentan-2-yl-5-propylpyrimidin-4-amine is sourced from PubChem (CID 80906528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).