6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine

C12H17N5O — CID 80907155

IUPAC6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine
SMILESCc1nc(NN)cc(N(C)Cc2ccc(C)o2)n1
InChIInChI=1S/C12H17N5O/c1-8-4-5-10(18-8)7-17(3)12-6-11(16-13)14-9(2)15-12/h4-6H,7,13H2,1-3H3,(H,14,15,16)
InChIKeyYZQIXCHDFDFVPH-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.61
Rot. Bonds4

About 6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine

6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine (PubChem CID 80907155) has the molecular formula C12H17N5O and a molecular weight of 247.30 g/mol. Its IUPAC name is 6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine
PubChem CID80907155
Molecular FormulaC12H17N5O
Molecular Weight247.30 g/mol
Exact Mass247.14
IUPAC Name6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine
SMILESCc1nc(NN)cc(N(C)Cc2ccc(C)o2)n1
InChIInChI=1S/C12H17N5O/c1-8-4-5-10(18-8)7-17(3)12-6-11(16-13)14-9(2)15-12/h4-6H,7,13H2,1-3H3,(H,14,15,16)
InChIKeyYZQIXCHDFDFVPH-UHFFFAOYSA-N
XLogP1.61
TPSA80.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.61
H-Bond Donors ≤ 52
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

6-hydrazinyl-N,2-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
CID 80907338
4-N,6-N-dimethyl-4-N-[(5-methylfuran-2-yl)methyl]-2-methylsulfanylpyrimidine-4,6-diamine
CID 80781028
N-[(2-fluorophenyl)methyl]-6-hydrazinyl-N,2-dimethylpyrimidin-4-amine
CID 80899402
4-N-methyl-4-N-[(5-methylfuran-2-yl)methyl]-2-methylsulfanylpyrimidine-4,6-diamine
CID 80781793
2-N,6-N-dimethyl-6-N-[(5-methylfuran-2-yl)methyl]pyridine-2,6-diamine
CID 80781469
3-[[(6-hydrazinyl-2-methylpyrimidin-4-yl)-methylamino]methyl]benzonitrile
CID 80918950
6-N-methyl-6-N-[(5-methylfuran-2-yl)methyl]-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717523
N-methyl-N-[(5-methylfuran-2-yl)methyl]-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-2-amine
CID 133382324
3-[(6-hydrazinyl-2-methylpyrimidin-4-yl)-methylamino]-N,2-dimethylpropanamide
CID 106918798
[6-[methyl-[(5-methylfuran-2-yl)methyl]amino]pyrazin-2-yl]methanol
CID 66466599
N-methyl-6-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine
CID 62280117
2-N,4-N,4-N-trimethyl-2-N-[(5-methylfuran-2-yl)methyl]-1,3,5-triazine-2,4,6-triamine
CID 80782080

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine (CID 80907155) is 6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine is Cc1nc(NN)cc(N(C)Cc2ccc(C)o2)n1.
What is the InChIKey of 6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is YZQIXCHDFDFVPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O/c1-8-4-5-10(18-8)7-17(3)12-6-11(16-13)14-9(2)15-12/h4-6H,7,13H2,1-3H3,(H,14,15,16).
What are the key properties of 6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine?
6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 247.30 g/mol, XLogP of 1.61, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 80907155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).