N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine

C15H28N6 — CID 107165595

IUPACN-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCCc1nc(NN)c(C)c(NCC2(C)CCN(C)CC2)n1
InChIInChI=1S/C15H28N6/c1-5-12-18-13(11(2)14(19-12)20-16)17-10-15(3)6-8-21(4)9-7-15/h5-10,16H2,1-4H3,(H2,17,18,19,20)
InChIKeyTVDSGLQQXSBDIG-UHFFFAOYSA-N
MW292.43 g/mol
LogP1.78
Rot. Bonds5

About N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine

N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine (PubChem CID 107165595) has the molecular formula C15H28N6 and a molecular weight of 292.43 g/mol. Its IUPAC name is N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine
PubChem CID107165595
Molecular FormulaC15H28N6
Molecular Weight292.43 g/mol
Exact Mass292.24
IUPAC NameN-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCCc1nc(NN)c(C)c(NCC2(C)CCN(C)CC2)n1
InChIInChI=1S/C15H28N6/c1-5-12-18-13(11(2)14(19-12)20-16)17-10-15(3)6-8-21(4)9-7-15/h5-10,16H2,1-4H3,(H2,17,18,19,20)
InChIKeyTVDSGLQQXSBDIG-UHFFFAOYSA-N
XLogP1.78
TPSA79.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 51.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
The IUPAC name of N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine (CID 107165595) is N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
The canonical SMILES for N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine is CCc1nc(NN)c(C)c(NCC2(C)CCN(C)CC2)n1.
What is the InChIKey of N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
The InChIKey is TVDSGLQQXSBDIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N6/c1-5-12-18-13(11(2)14(19-12)20-16)17-10-15(3)6-8-21(4)9-7-15/h5-10,16H2,1-4H3,(H2,17,18,19,20).
What are the key properties of N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine?
N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine has a molecular weight of 292.43 g/mol, XLogP of 1.78, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,4-dimethylpiperidin-4-yl)methyl]-2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 107165595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).