6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine

C12H18N6O — CID 106424779

IUPAC6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NN)c(C)c(NCc2ccno2)n1
InChIInChI=1S/C12H18N6O/c1-3-4-10-16-11(8(2)12(17-10)18-13)14-7-9-5-6-15-19-9/h5-6H,3-4,7,13H2,1-2H3,(H2,14,16,17,18)
InChIKeyKYFWLBDVBSGYET-UHFFFAOYSA-N
MW262.32 g/mol
LogP1.62
Rot. Bonds6

About 6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine

6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine (PubChem CID 106424779) has the molecular formula C12H18N6O and a molecular weight of 262.32 g/mol. Its IUPAC name is 6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine
PubChem CID106424779
Molecular FormulaC12H18N6O
Molecular Weight262.32 g/mol
Exact Mass262.15
IUPAC Name6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NN)c(C)c(NCc2ccno2)n1
InChIInChI=1S/C12H18N6O/c1-3-4-10-16-11(8(2)12(17-10)18-13)14-7-9-5-6-15-19-9/h5-6H,3-4,7,13H2,1-2H3,(H2,14,16,17,18)
InChIKeyKYFWLBDVBSGYET-UHFFFAOYSA-N
XLogP1.62
TPSA101.89 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 51.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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-5-methyl-N-(1,2-oxazol-5-ylmethyl)pyrimidin-4-amine
CID 106424788
2-ethyl-5-methyl-4-N-(1,2-oxazol-5-ylmethyl)pyrimidine-4,6-diamine
CID 106424568
6-hydrazinyl-5-methyl-N-(1,2,4-oxadiazol-3-ylmethyl)-2-propylpyrimidin-4-amine
CID 106412418
6-hydrazinyl-5-methyl-N-[(1-methylpyrazol-3-yl)methyl]-2-propylpyrimidin-4-amine
CID 82874497
6-hydrazinyl-5-methyl-N-[(3-methylthiophen-2-yl)methyl]-2-propylpyrimidin-4-amine
CID 81007066
6-hydrazinyl-5-methyl-N-(2-methylpropyl)-2-propylpyrimidin-4-amine
CID 81001135
N-(4-fluorophenyl)-6-hydrazinyl-5-methyl-2-propylpyrimidin-4-amine
CID 81007658
N-[2-(5-bromothiophen-2-yl)ethyl]-6-hydrazinyl-5-methyl-2-propylpyrimidin-4-amine
CID 106043930
N',N'-diethyl-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)ethane-1,2-diamine
CID 81000696
1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine
CID 81006767
6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propylpyrimidin-4-amine
CID 81006405
6-hydrazinyl-N-(2-methoxy-2-methylpropyl)-5-methyl-2-propylpyrimidin-4-amine
CID 113451063

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine (CID 106424779) is 6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine is CCCc1nc(NN)c(C)c(NCc2ccno2)n1.
What is the InChIKey of 6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine?
The InChIKey is KYFWLBDVBSGYET-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6O/c1-3-4-10-16-11(8(2)12(17-10)18-13)14-7-9-5-6-15-19-9/h5-6H,3-4,7,13H2,1-2H3,(H2,14,16,17,18).
What are the key properties of 6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine?
6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine has a molecular weight of 262.32 g/mol, XLogP of 1.62, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-5-methyl-N-(1,2-oxazol-5-ylmethyl)-2-propylpyrimidin-4-amine is sourced from PubChem (CID 106424779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).