6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine

C10H16F2N4 — CID 145361154

IUPAC6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine
SMILESCc1cc(CN)nnc1N(CCF)CCF
InChIInChI=1S/C10H16F2N4/c1-8-6-9(7-13)14-15-10(8)16(4-2-11)5-3-12/h6H,2-5,7,13H2,1H3
InChIKeyVXCLNWFDRQGOMN-UHFFFAOYSA-N
MW230.26 g/mol
LogP0.99
Rot. Bonds6

About 6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine

6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine (PubChem CID 145361154) has the molecular formula C10H16F2N4 and a molecular weight of 230.26 g/mol. Its IUPAC name is 6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine
PubChem CID145361154
Molecular FormulaC10H16F2N4
Molecular Weight230.26 g/mol
Exact Mass230.13
IUPAC Name6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine
SMILESCc1cc(CN)nnc1N(CCF)CCF
InChIInChI=1S/C10H16F2N4/c1-8-6-9(7-13)14-15-10(8)16(4-2-11)5-3-12/h6H,2-5,7,13H2,1H3
InChIKeyVXCLNWFDRQGOMN-UHFFFAOYSA-N
XLogP0.99
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine?
The IUPAC name of 6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine (CID 145361154) is 6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine.
What is the SMILES notation for 6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine?
The canonical SMILES for 6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine is Cc1cc(CN)nnc1N(CCF)CCF.
What is the InChIKey of 6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine?
The InChIKey is VXCLNWFDRQGOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F2N4/c1-8-6-9(7-13)14-15-10(8)16(4-2-11)5-3-12/h6H,2-5,7,13H2,1H3.
What are the key properties of 6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine?
6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine has a molecular weight of 230.26 g/mol, XLogP of 0.99, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N,N-bis(2-fluoroethyl)-4-methylpyridazin-3-amine is sourced from PubChem (CID 145361154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).