2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine

C11H15N5O — CID 80937643

IUPAC2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine
SMILESCCc1nc(NN)cc(NCc2ccco2)n1
InChIInChI=1S/C11H15N5O/c1-2-9-14-10(6-11(15-9)16-12)13-7-8-4-3-5-17-8/h3-6H,2,7,12H2,1H3,(H2,13,14,15,16)
InChIKeyYMLVVCXMVKQYQT-UHFFFAOYSA-N
MW233.28 g/mol
LogP1.53
Rot. Bonds5

About 2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine

2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine (PubChem CID 80937643) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is 2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine
PubChem CID80937643
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC Name2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine
SMILESCCc1nc(NN)cc(NCc2ccco2)n1
InChIInChI=1S/C11H15N5O/c1-2-9-14-10(6-11(15-9)16-12)13-7-8-4-3-5-17-8/h3-6H,2,7,12H2,1H3,(H2,13,14,15,16)
InChIKeyYMLVVCXMVKQYQT-UHFFFAOYSA-N
XLogP1.53
TPSA89.00 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 51.53
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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Related Compounds

2-ethyl-N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)pyrimidin-4-amine
CID 82454475
6-N-ethyl-4-N-(furan-2-ylmethyl)-2-methylsulfanylpyrimidine-4,6-diamine
CID 80765455
2-ethyl-N-[(3-fluorophenyl)methyl]-6-hydrazinylpyrimidin-4-amine
CID 80939549
4-N-(2-ethylphenyl)-6-N-(furan-2-ylmethyl)-2-methylpyrimidine-4,6-diamine
CID 112871392
2-tert-butyl-N-[2-(furan-2-yl)ethyl]-6-hydrazinylpyrimidin-4-amine
CID 80964340
4-N-(2-ethyl-6-methylphenyl)-6-N-(furan-2-ylmethyl)-2-methylpyrimidine-4,6-diamine
CID 112871395
6-N-butyl-4-N-(furan-2-ylmethyl)-2-phenylpyrimidine-4,6-diamine
CID 112879724
4-N-(2,6-dimethylphenyl)-6-N-(furan-2-ylmethyl)-2-methylpyrimidine-4,6-diamine
CID 112871390
4-N-[2-(furan-2-yl)ethyl]-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80941818
N-(furan-2-ylmethyl)-6-(2-methoxyethoxy)-2-(methoxymethyl)pyrimidin-4-amine
CID 82456733
4-N-(2,6-diethylphenyl)-6-N-(furan-2-ylmethyl)pyrimidine-4,6-diamine
CID 112858634
4-N-tert-butyl-6-N-(furan-2-ylmethyl)pyrimidine-4,6-diamine
CID 112858600

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine?
The IUPAC name of 2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine (CID 80937643) is 2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine?
The canonical SMILES for 2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine is CCc1nc(NN)cc(NCc2ccco2)n1.
What is the InChIKey of 2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine?
The InChIKey is YMLVVCXMVKQYQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-2-9-14-10(6-11(15-9)16-12)13-7-8-4-3-5-17-8/h3-6H,2,7,12H2,1H3,(H2,13,14,15,16).
What are the key properties of 2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine?
2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine has a molecular weight of 233.28 g/mol, XLogP of 1.53, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(furan-2-ylmethyl)-6-hydrazinylpyrimidin-4-amine is sourced from PubChem (CID 80937643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).