5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine

C19H24FN5O — CID 31015572

IUPAC5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine
SMILESFc1cccc(-c2cnnc(NCC3(N4CCOCC4)CCCC3)n2)c1
InChIInChI=1S/C19H24FN5O/c20-16-5-3-4-15(12-16)17-13-22-24-18(23-17)21-14-19(6-1-2-7-19)25-8-10-26-11-9-25/h3-5,12-13H,1-2,6-11,14H2,(H,21,23,24)
InChIKeyIQIAJFWIYRWMEI-UHFFFAOYSA-N
MW357.43 g/mol
LogP2.73
Rot. Bonds5

About 5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine

5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine (PubChem CID 31015572) has the molecular formula C19H24FN5O and a molecular weight of 357.43 g/mol. Its IUPAC name is 5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine.

Molecular Properties

Compound Name5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine
PubChem CID31015572
Molecular FormulaC19H24FN5O
Molecular Weight357.43 g/mol
Exact Mass357.20
IUPAC Name5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine
SMILESFc1cccc(-c2cnnc(NCC3(N4CCOCC4)CCCC3)n2)c1
InChIInChI=1S/C19H24FN5O/c20-16-5-3-4-15(12-16)17-13-22-24-18(23-17)21-14-19(6-1-2-7-19)25-8-10-26-11-9-25/h3-5,12-13H,1-2,6-11,14H2,(H,21,23,24)
InChIKeyIQIAJFWIYRWMEI-UHFFFAOYSA-N
XLogP2.73
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(3-fluorophenyl)-N-(3-morpholin-4-ylpropyl)-1,2,4-triazin-3-amine
CID 29029101
5-(3-fluorophenyl)-N-(2-methyl-2-morpholin-4-ylpropyl)-1,2,4-triazin-3-amine
CID 25368700
N-[(1-morpholin-4-ylcyclohexyl)methyl]-4-pyridin-4-ylpyrimidin-2-amine
CID 72860191
4-methyl-N-[(1-morpholin-4-ylcyclopentyl)methyl]pyrimidin-2-amine
CID 72915197
3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide
CID 139028737
1-[5-(3-fluorophenyl)-1,2,4-triazin-3-yl]azepane
CID 25373449
5-(3-fluorophenyl)-N-(3-indol-1-ylpropyl)-1,2,4-triazin-3-amine
CID 42454381
3-fluoro-N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]benzamide
CID 78784195
6-(2-methylphenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-5H-cyclopenta[d]pyrimidin-2-amine
CID 157444199
2-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]pyridin-4-amine
CID 131909403
[3-(3-fluorophenyl)-1,2-oxazol-5-yl]-morpholin-4-ylmethanone
CID 46471000
2-(2,4-difluorophenoxy)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 39430568

Frequently Asked Questions

What is the IUPAC name of 5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine?
The IUPAC name of 5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine (CID 31015572) is 5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine.
What is the SMILES notation for 5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine?
The canonical SMILES for 5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine is Fc1cccc(-c2cnnc(NCC3(N4CCOCC4)CCCC3)n2)c1.
What is the InChIKey of 5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine?
The InChIKey is IQIAJFWIYRWMEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN5O/c20-16-5-3-4-15(12-16)17-13-22-24-18(23-17)21-14-19(6-1-2-7-19)25-8-10-26-11-9-25/h3-5,12-13H,1-2,6-11,14H2,(H,21,23,24).
What are the key properties of 5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine?
5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine has a molecular weight of 357.43 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluorophenyl)-N-[(1-morpholin-4-ylcyclopentyl)methyl]-1,2,4-triazin-3-amine is sourced from PubChem (CID 31015572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).