6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine

C11H17N7 — CID 80913792

IUPAC6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
SMILESCc1nc(NN)c(C)c(NCc2nccn2C)n1
InChIInChI=1S/C11H17N7/c1-7-10(15-8(2)16-11(7)17-12)14-6-9-13-4-5-18(9)3/h4-5H,6,12H2,1-3H3,(H2,14,15,16,17)
InChIKeyKUUWNKNONCBRCE-UHFFFAOYSA-N
MW247.31 g/mol
LogP0.72
Rot. Bonds4

About 6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine

6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine (PubChem CID 80913792) has the molecular formula C11H17N7 and a molecular weight of 247.31 g/mol. Its IUPAC name is 6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
PubChem CID80913792
Molecular FormulaC11H17N7
Molecular Weight247.31 g/mol
Exact Mass247.15
IUPAC Name6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
SMILESCc1nc(NN)c(C)c(NCc2nccn2C)n1
InChIInChI=1S/C11H17N7/c1-7-10(15-8(2)16-11(7)17-12)14-6-9-13-4-5-18(9)3/h4-5H,6,12H2,1-3H3,(H2,14,15,16,17)
InChIKeyKUUWNKNONCBRCE-UHFFFAOYSA-N
XLogP0.72
TPSA93.68 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.31
LogP ≤ 50.72
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

3-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazin-2-amine
CID 83062959
6-ethyl-5-methyl-4-N-[(1-methylimidazol-2-yl)methyl]pyrimidine-2,4-diamine
CID 135118772
5-fluoro-2-hydrazinyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 80914824
6-hydrazinyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-2-amine
CID 80913707
2-hydrazinyl-6-methyl-N-[(1-methylimidazol-2-yl)methyl]-5-nitropyrimidin-4-amine
CID 114045033
2,3-dimethyl-4-N-[(1-methylimidazol-2-yl)methyl]benzene-1,4-diamine
CID 138489685
4-ethoxy-6-hydrazinyl-N-[(1-methylimidazol-2-yl)methyl]-1,3,5-triazin-2-amine
CID 80914033
8-N-[(1-methylimidazol-2-yl)methyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80829250
[2,5-dimethyl-6-(2-propylimidazol-1-yl)pyrimidin-4-yl]hydrazine
CID 80903201
2-ethyl-6-hydrazinyl-N,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 81007702
6-methoxy-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,3-diamine
CID 115320795
5-bromo-2-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,3-diamine
CID 63293701

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine (CID 80913792) is 6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine is Cc1nc(NN)c(C)c(NCc2nccn2C)n1.
What is the InChIKey of 6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is KUUWNKNONCBRCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N7/c1-7-10(15-8(2)16-11(7)17-12)14-6-9-13-4-5-18(9)3/h4-5H,6,12H2,1-3H3,(H2,14,15,16,17).
What are the key properties of 6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine?
6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 247.31 g/mol, XLogP of 0.72, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-2,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 80913792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).