6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine

C19H25F2N3O3 — CID 10249269

IUPAC6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine
SMILESCCC(CC)Oc1nc(C)c(-c2ccc(OC(F)F)cc2OC)nc1NC
InChIInChI=1S/C19H25F2N3O3/c1-6-12(7-2)26-18-17(22-4)24-16(11(3)23-18)14-9-8-13(27-19(20)21)10-15(14)25-5/h8-10,12,19H,6-7H2,1-5H3,(H,22,24)
InChIKeyIWRMFEVIMUXNGZ-UHFFFAOYSA-N
MW381.42 g/mol
LogP4.67
Rot. Bonds9

About 6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine

6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine (PubChem CID 10249269) has the molecular formula C19H25F2N3O3 and a molecular weight of 381.42 g/mol. Its IUPAC name is 6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine.

Molecular Properties

Compound Name6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine
PubChem CID10249269
Molecular FormulaC19H25F2N3O3
Molecular Weight381.42 g/mol
Exact Mass381.19
IUPAC Name6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine
SMILESCCC(CC)Oc1nc(C)c(-c2ccc(OC(F)F)cc2OC)nc1NC
InChIInChI=1S/C19H25F2N3O3/c1-6-12(7-2)26-18-17(22-4)24-16(11(3)23-18)14-9-8-13(27-19(20)21)10-15(14)25-5/h8-10,12,19H,6-7H2,1-5H3,(H,22,24)
InChIKeyIWRMFEVIMUXNGZ-UHFFFAOYSA-N
XLogP4.67
TPSA65.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.42
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-hexan-3-yloxy-6-(2-methoxy-4-propan-2-yloxyphenyl)-N,5-dimethylpyrazin-2-amine
CID 58804434
6-[4-[difluoro(phosphanyl)methoxy]-2-methoxyphenyl]-3-hexan-3-yloxy-N,5-dimethylpyrazin-2-amine
CID 142866393
5-bromo-6-[2-methoxy-4-(trifluoromethoxy)phenyl]-N-methyl-3-pentan-3-yloxypyrazin-2-amine
CID 10073115
5-bromo-3-hexan-3-yloxy-6-[2-methoxy-4-(trifluoromethoxy)phenyl]-N-methylpyrazin-2-amine
CID 10390312
6-(5-ethyl-6-methoxy-2-methyl-3-pyridinyl)-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine
CID 58804532
6-[4-methoxy-2-(trifluoromethoxy)phenyl]-N,5-dimethyl-3-pentan-3-yloxypyridin-2-amine
CID 21104809
6-[2,5-dimethyl-6-(propan-2-ylamino)-3-pyridinyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine
CID 58804553
3-ethoxy-5-[2-methoxy-4-(trifluoromethoxy)phenyl]-6-methyl-N-pentan-3-ylpyrazin-2-amine
CID 58804534
5-ethyl-6-[2-methoxy-4-(trifluoromethoxy)phenyl]-2-N-methyl-3-N-pentan-3-ylpyrazine-2,3-diamine
CID 10386972
5-bromo-3-hexoxy-6-(2-methoxy-4-propan-2-yloxyphenyl)-N-methylpyrazin-2-amine
CID 87956170
5-bromo-6-(2-chloro-4-methoxyphenyl)-3-hexan-3-yloxy-N-methylpyrazin-2-amine
CID 58804456
5-[2-methoxy-4-(trifluoromethoxy)phenyl]-6-methyl-N-pentan-3-ylpyrazin-2-amine
CID 58804425

Frequently Asked Questions

What is the IUPAC name of 6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine?
The IUPAC name of 6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine (CID 10249269) is 6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine.
What is the SMILES notation for 6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine?
The canonical SMILES for 6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine is CCC(CC)Oc1nc(C)c(-c2ccc(OC(F)F)cc2OC)nc1NC.
What is the InChIKey of 6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine?
The InChIKey is IWRMFEVIMUXNGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25F2N3O3/c1-6-12(7-2)26-18-17(22-4)24-16(11(3)23-18)14-9-8-13(27-19(20)21)10-15(14)25-5/h8-10,12,19H,6-7H2,1-5H3,(H,22,24).
What are the key properties of 6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine?
6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine has a molecular weight of 381.42 g/mol, XLogP of 4.67, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(difluoromethoxy)-2-methoxyphenyl]-N,5-dimethyl-3-pentan-3-yloxypyrazin-2-amine is sourced from PubChem (CID 10249269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).