N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine

C14H15F2N3 — CID 133471598

IUPACN-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine
SMILESCCC(Nc1cncc(C)n1)c1ccc(F)cc1F
InChIInChI=1S/C14H15F2N3/c1-3-13(11-5-4-10(15)6-12(11)16)19-14-8-17-7-9(2)18-14/h4-8,13H,3H2,1-2H3,(H,18,19)
InChIKeyPIGVWOUISKGERA-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.63
Rot. Bonds4

About N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine

N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine (PubChem CID 133471598) has the molecular formula C14H15F2N3 and a molecular weight of 263.29 g/mol. Its IUPAC name is N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine.

Molecular Properties

Compound NameN-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine
PubChem CID133471598
Molecular FormulaC14H15F2N3
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC NameN-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine
SMILESCCC(Nc1cncc(C)n1)c1ccc(F)cc1F
InChIInChI=1S/C14H15F2N3/c1-3-13(11-5-4-10(15)6-12(11)16)19-14-8-17-7-9(2)18-14/h4-8,13H,3H2,1-2H3,(H,18,19)
InChIKeyPIGVWOUISKGERA-UHFFFAOYSA-N
XLogP3.63
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2,4-difluorophenyl)ethyl]-6-methylpyrazin-2-amine
CID 133471001
1-(2,4-difluorophenyl)-N-propan-2-ylpropan-1-amine
CID 115641478
6-N-[(1R)-1-(2,4-difluorophenyl)propyl]-1-methylpyrazolo[3,4-d]pyrimidine-4,6-diamine
CID 125139178
1-(2,4-difluorophenyl)-N-propylethane-1,2-diamine
CID 62064444
2-[(6-methylpyrazin-2-yl)amino]-2-(4-propan-2-ylphenyl)ethanol
CID 167928187
N-(2-bromoprop-2-enyl)-1-(2,4-difluorophenyl)propan-1-amine
CID 115717252
(S)-N-[1-(2,4-difluorophenyl)propyl]-2-methylpropane-2-sulfinamide
CID 129130094
N-[(2-bromo-4-fluorophenyl)methyl]-6-methylpyrazin-2-amine
CID 133468470
1,2-bis(2,4-difluorophenyl)-N-ethylethanamine
CID 63084221
1-(2,4-difluorophenyl)-N,3-dimethylpentan-1-amine
CID 63084219
2-amino-N-[1-(2,4-difluorophenyl)propyl]acetamide
CID 119330686
N-[1-(2,4-difluorophenyl)-2-pyridin-3-ylethyl]propan-1-amine
CID 62802705

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine?
The IUPAC name of N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine (CID 133471598) is N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine.
What is the SMILES notation for N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine?
The canonical SMILES for N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine is CCC(Nc1cncc(C)n1)c1ccc(F)cc1F.
What is the InChIKey of N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine?
The InChIKey is PIGVWOUISKGERA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3/c1-3-13(11-5-4-10(15)6-12(11)16)19-14-8-17-7-9(2)18-14/h4-8,13H,3H2,1-2H3,(H,18,19).
What are the key properties of N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine?
N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine has a molecular weight of 263.29 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-difluorophenyl)propyl]-6-methylpyrazin-2-amine is sourced from PubChem (CID 133471598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).