N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine

C10H19N5O — CID 80943910

IUPACN-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCCOCCCNc1ncnc(NN)c1C
InChIInChI=1S/C10H19N5O/c1-3-16-6-4-5-12-9-8(2)10(15-11)14-7-13-9/h7H,3-6,11H2,1-2H3,(H2,12,13,14,15)
InChIKeyZQDCKQUVMFMNPA-UHFFFAOYSA-N
MW225.30 g/mol
LogP0.91
Rot. Bonds7

About N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine

N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine (PubChem CID 80943910) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine
PubChem CID80943910
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC NameN-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine
SMILESCCOCCCNc1ncnc(NN)c1C
InChIInChI=1S/C10H19N5O/c1-3-16-6-4-5-12-9-8(2)10(15-11)14-7-13-9/h7H,3-6,11H2,1-2H3,(H2,12,13,14,15)
InChIKeyZQDCKQUVMFMNPA-UHFFFAOYSA-N
XLogP0.91
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 50.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-butoxyethyl)-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 80903690
ethyl 4-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]butanoate
CID 80915942
3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propan-1-ol
CID 80943609
4-N-(3-ethoxypropyl)-5-ethyl-6-N-methylpyrimidine-4,6-diamine
CID 80771977
5-bromo-4-N-(3-ethoxypropyl)-6-N-ethylpyrimidine-4,6-diamine
CID 114071942
N-(3-ethoxypropyl)-6-hydrazinylpyrimidin-4-amine
CID 80944066
N-(6-hydrazinyl-5-methylpyrimidin-4-yl)-N'-methyl-N'-propan-2-ylpropane-1,3-diamine
CID 106043625
5-bromo-N-(3-ethoxypropyl)pyrimidin-4-amine
CID 66343219
6-methoxy-5-methyl-N-(3-propoxypropyl)pyrimidin-4-amine
CID 82943748
N-[(4-ethylcyclohexyl)methyl]-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 80902835
4-N-(3-methoxypropyl)-5-methylpyrimidine-4,6-diamine
CID 80772369
6-hydrazinyl-5-methyl-N-[2-(4-methylcyclohexyl)ethyl]pyrimidin-4-amine
CID 80913396

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine?
The IUPAC name of N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine (CID 80943910) is N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine?
The canonical SMILES for N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine is CCOCCCNc1ncnc(NN)c1C.
What is the InChIKey of N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine?
The InChIKey is ZQDCKQUVMFMNPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-3-16-6-4-5-12-9-8(2)10(15-11)14-7-13-9/h7H,3-6,11H2,1-2H3,(H2,12,13,14,15).
What are the key properties of N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine?
N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine has a molecular weight of 225.30 g/mol, XLogP of 0.91, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80943910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).