2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine

C7H12FN5 — CID 141303995

IUPAC2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine
SMILESCCc1nc(NC)c(F)c(NN)n1
InChIInChI=1S/C7H12FN5/c1-3-4-11-6(10-2)5(8)7(12-4)13-9/h3,9H2,1-2H3,(H2,10,11,12,13)
InChIKeyMWKFGTWCXSOHGP-UHFFFAOYSA-N
MW185.21 g/mol
LogP0.51
Rot. Bonds3

About 2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine

2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine (PubChem CID 141303995) has the molecular formula C7H12FN5 and a molecular weight of 185.21 g/mol. Its IUPAC name is 2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine
PubChem CID141303995
Molecular FormulaC7H12FN5
Molecular Weight185.21 g/mol
Exact Mass185.11
IUPAC Name2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine
SMILESCCc1nc(NC)c(F)c(NN)n1
InChIInChI=1S/C7H12FN5/c1-3-4-11-6(10-2)5(8)7(12-4)13-9/h3,9H2,1-2H3,(H2,10,11,12,13)
InChIKeyMWKFGTWCXSOHGP-UHFFFAOYSA-N
XLogP0.51
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.21
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

5-Fluoro-4-hydrazinyl-2-methylpyrimidine
CID 33735255
[6-(Azetidin-1-yl)-5-fluoro-2-methylpyrimidin-4-yl]hydrazine
CID 55281035
5-Fluoro-2-methylpyrimidine-4,6-diamine
CID 57422049
4-[(2S)-2,4-dimethyl-1-piperazinyl]-5-fluoro-6-hydrazino-2-methylpyrimidine
CID 66935927
2-Ethyl-5-fluoro-4-hydrazino-6-(4-methyl-1-piperazinyl)pyrimidine
CID 66935975
4-(1-Azetidinyl)-2-ethyl-5-fluoro-6-hydrazinopyrimidine
CID 66936000
5-Fluoro-4-hydrazino-2-methyl-6-(1-pyrrolidinyl)pyrimidine
CID 66936020
4-[(2R)-2,4-dimethyl-1-piperazinyl]-5-fluoro-6-hydrazino-2-methylpyrimidine
CID 66936055
2-(Difluoromethyl)-5-fluoro-4-hydrazino-6-(4-methyl-1-piperazinyl)pyrimidine
CID 66936083
4-[(3R)-3,4-dimethyl-1-piperazinyl]-5-fluoro-6-hydrazino-2-methylpyrimidine
CID 66936099
4-[(3S)-3,4-dimethyl-1-piperazinyl]-5-fluoro-6-hydrazino-2-methylpyrimidine
CID 66936103
4-(2,5-dihydro-1H-pyrrol-1-yl)-5-fluoro-6-hydrazino-2-methylpyrimidine
CID 66936187

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine?
The IUPAC name of 2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine (CID 141303995) is 2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine?
The canonical SMILES for 2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine is CCc1nc(NC)c(F)c(NN)n1.
What is the InChIKey of 2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine?
The InChIKey is MWKFGTWCXSOHGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FN5/c1-3-4-11-6(10-2)5(8)7(12-4)13-9/h3,9H2,1-2H3,(H2,10,11,12,13).
What are the key properties of 2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine?
2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine has a molecular weight of 185.21 g/mol, XLogP of 0.51, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-fluoro-6-hydrazinyl-N-methylpyrimidin-4-amine is sourced from PubChem (CID 141303995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).